data_2nax_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 2nax _Structure_validation_residue.Date_analyzed 2016-11-18 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 ' 546' ' ' ILE . . . . . . . . . . . . . 18.0 mm . . . . . 0 N--CA 1.475 0.808 0 CA-C-O 120.74 0.305 . . . . 0.0 110.914 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 8.1 tmm_? -76.49 -23.83 53.79 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.919 1.288 . . . . 0.0 112.815 -177.243 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -71.45 -12.04 72.72 Favored Glycine 0 CA--C 1.541 1.689 0 C-N-CA 124.721 1.153 . . . . 0.0 115.579 175.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 71.8 mmtt -68.23 152.54 45.31 Favored 'General case' 0 N--CA 1.476 0.864 0 CA-C-N 119.108 1.454 . . . . 0.0 112.79 178.787 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 51.1 p90 -154.82 166.12 34.47 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 124.867 1.267 . . . . 0.0 112.629 172.796 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 1.6 m -135.35 140.2 45.32 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.885 0 C-N-CA 126.326 1.851 . . . . 0.0 110.294 175.767 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 78.8 t -69.07 130.9 34.22 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.232 0 O-C-N 121.297 -0.877 . . . . 0.0 111.278 -177.462 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 11.2 t -79.26 122.44 84.16 Favored Pre-proline 0 CA--C 1.541 0.602 0 C-N-CA 124.183 0.993 . . . . 0.0 110.01 172.286 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -75.8 156.39 39.46 Favored 'Trans proline' 0 CA--C 1.537 0.663 0 C-N-CA 122.56 2.173 . . . . 0.0 112.251 176.484 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 15.7 pm0 -66.43 -17.25 64.68 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 124.295 1.038 . . . . 0.0 113.493 174.205 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 74.2 p -81.34 -9.28 59.78 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 125.891 1.677 . . . . 0.0 113.06 172.726 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 43.9 t -59.79 141.15 55.84 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 119.293 0.951 . . . . 0.0 113.225 179.451 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 88.3 mm-40 -75.11 97.13 3.38 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 124.115 0.966 . . . . 0.0 110.132 173.02 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 30.0 m-20 55.25 25.62 7.57 Favored 'General case' 0 CA--C 1.554 1.107 0 C-N-CA 126.288 1.835 . . . . 0.0 114.808 177.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 8.1 mtt 57.32 32.99 22.65 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 125.6 1.56 . . . . 0.0 114.707 179.391 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -137.8 149.4 46.34 Favored 'General case' 0 CA--C 1.538 0.489 0 N-CA-C 115.058 1.503 . . . . 0.0 115.058 -173.39 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 24.5 m-85 -149.25 165.68 31.19 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 127.34 2.256 . . . . 0.0 110.014 171.322 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 19.7 ttmm -117.95 133.9 55.47 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 123.928 0.891 . . . . 0.0 112.317 -179.092 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 14.4 t -73.59 111.73 13.26 Favored Pre-proline 0 CA--C 1.547 0.856 0 C-N-CA 127.045 2.138 . . . . 0.0 110.483 170.487 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 79.9 Cg_endo -70.64 -15.41 33.79 Favored 'Trans proline' 0 CA--C 1.542 0.913 0 C-N-CA 122.728 2.285 . . . . 0.0 114.132 175.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 93.0 mt -73.7 -56.12 10.33 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.823 0 C-N-CA 124.307 1.043 . . . . 0.0 110.924 -178.866 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 13.8 p -102.38 -1.68 30.36 Favored 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 124.752 1.221 . . . . 0.0 113.901 -179.816 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 568' ' ' LYS . . . . . . . . . . . . . 33.1 mmtp 62.65 41.67 9.08 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 127.072 2.149 . . . . 0.0 113.462 -178.173 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 75.0 mm-40 -122.76 145.62 48.25 Favored 'General case' 0 N--CA 1.482 1.175 0 N-CA-C 113.841 1.052 . . . . 0.0 113.841 -174.251 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 28.0 m -94.16 121.06 35.28 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.661 0.784 . . . . 0.0 111.463 -173.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 4.8 m -80.2 148.65 5.6 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.675 0 C-N-CA 124.62 1.168 . . . . 0.0 111.358 168.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 45.5 p -132.69 144.46 50.32 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 124.93 1.292 . . . . 0.0 111.193 174.843 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -67.31 152.17 52.59 Favored Glycine 0 CA--C 1.539 1.563 0 C-N-CA 124.419 1.009 . . . . 0.0 113.94 176.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 46.3 t -133.19 137.74 52.83 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.956 0 C-N-CA 125.937 1.695 . . . . 0.0 111.108 178.591 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 33.3 t80 -69.95 140.92 53.09 Favored 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 114.51 1.3 . . . . 0.0 114.51 -173.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 40.1 t0 -114.33 108.5 17.0 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 127.341 2.257 . . . . 0.0 110.469 170.858 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -66.23 -27.5 68.02 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 114.317 1.229 . . . . 0.0 114.317 -179.461 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -74.92 -50.76 15.73 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-N 118.994 0.815 . . . . 0.0 112.09 -176.79 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 25.3 t -77.52 -31.95 53.76 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 123.452 0.701 . . . . 0.0 111.704 174.255 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 81.92 29.53 38.07 Favored Glycine 0 CA--C 1.53 1.012 0 C-N-CA 124.011 0.815 . . . . 0.0 112.201 -173.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 80.0 mm-40 -129.61 -174.08 3.2 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 126.529 1.932 . . . . 0.0 110.156 -176.422 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 53.8 m95 -117.99 156.63 28.21 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.458 1.103 . . . . 0.0 110.986 178.815 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 17.7 m -137.62 140.36 41.57 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 C-N-CA 125.505 1.522 . . . . 0.0 112.816 -177.473 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 1.1 m0 -90.95 105.6 17.94 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 126.575 1.95 . . . . 0.0 108.682 173.697 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 30.8 mmmt -72.27 142.52 48.91 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 125.144 1.378 . . . . 0.0 111.239 -177.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 57.9 t30 51.2 39.45 23.7 Favored 'General case' 0 CA--C 1.553 1.078 0 C-N-CA 125.633 1.573 . . . . 0.0 113.496 -177.247 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 89.7 m -124.01 149.63 45.8 Favored 'General case' 0 N--CA 1.482 1.129 0 O-C-N 120.629 -1.295 . . . . 0.0 112.966 -170.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 10.4 tt -141.51 137.27 32.4 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.636 0 C-N-CA 127.326 2.25 . . . . 0.0 110.638 178.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 77.5 tt0 -107.19 137.18 45.74 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 125.295 1.438 . . . . 0.0 109.664 169.715 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 7.6 p -151.71 123.29 1.06 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 C-N-CA 124.789 1.236 . . . . 0.0 110.847 179.084 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 35.3 m120 49.09 41.31 19.21 Favored 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 125.914 1.685 . . . . 0.0 114.11 174.433 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 85.97 1.41 86.85 Favored Glycine 0 CA--C 1.536 1.378 0 N-CA-C 116.071 1.189 . . . . 0.0 116.071 179.48 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -114.42 153.09 30.51 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 125.662 1.585 . . . . 0.0 111.984 177.469 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 42.0 m-85 -112.35 145.04 40.78 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 125.237 1.415 . . . . 0.0 111.937 177.8 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 99.1 m-85 -152.41 164.84 36.72 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 125.161 1.384 . . . . 0.0 111.541 -176.795 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 596' ' ' HIS . . . . . . . . . . . . . 21.4 m80 -78.15 144.51 36.35 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 166.501 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 19.5 t -64.16 -44.99 90.41 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 118.419 0.554 . . . . 0.0 111.365 178.29 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 22.8 p -64.09 -34.98 79.28 Favored 'General case' 0 N--CA 1.479 1.004 0 N-CA-C 114.016 1.117 . . . . 0.0 114.016 175.358 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 599' ' ' CYS . . . . . . . . . . . . . 87.9 m -71.53 -54.74 9.53 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 123.84 0.856 . . . . 0.0 111.22 176.226 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 70.7 t80 -61.04 -34.99 75.73 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 123.587 0.755 . . . . 0.0 112.606 -178.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 82.7 t60 -55.7 -31.88 62.83 Favored 'General case' 0 CA--C 1.543 0.688 0 O-C-N 121.167 -0.958 . . . . 0.0 113.554 176.394 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -73.27 -25.2 60.59 Favored 'General case' 0 CA--C 1.548 0.888 0 O-C-N 121.203 -0.935 . . . . 0.0 113.387 174.532 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 44.0 p . . . . . 0 N--CA 1.481 1.124 0 C-N-CA 125.384 1.474 . . . . 0.0 114.429 -175.439 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 12.0 mm . . . . . 0 N--CA 1.476 0.828 0 CA-C-O 120.467 0.175 . . . . 0.0 110.736 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 95.6 mtt-85 -77.84 -25.88 49.04 Favored 'General case' 0 N--CA 1.48 1.049 0 O-C-N 121.027 -1.046 . . . . 0.0 113.399 178.381 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -69.59 -9.01 61.08 Favored Glycine 0 CA--C 1.537 1.417 0 C-N-CA 125.537 1.541 . . . . 0.0 115.087 176.026 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -63.04 149.82 44.07 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-N 118.513 1.156 . . . . 0.0 111.714 170.744 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 45.6 p90 -156.44 166.61 32.93 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.205 1.002 . . . . 0.0 112.373 176.039 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 12.0 m -129.7 140.32 49.35 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 C-N-CA 126.299 1.84 . . . . 0.0 109.258 169.448 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 48.4 t -71.45 128.58 34.72 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.106 0 O-C-N 121.16 -0.963 . . . . 0.0 110.006 -177.225 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 4.0 t -79.72 126.37 80.51 Favored Pre-proline 0 CA--C 1.538 0.498 0 C-N-CA 123.78 0.832 . . . . 0.0 109.001 171.169 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -66.82 145.15 73.9 Favored 'Trans proline' 0 CA--C 1.538 0.698 0 C-N-CA 122.734 2.289 . . . . 0.0 112.248 -177.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 17.1 pt-20 -63.14 -17.13 62.01 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 113.49 0.922 . . . . 0.0 113.49 175.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 10.7 m -66.08 -30.86 71.45 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 125.436 1.494 . . . . 0.0 112.002 171.729 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 28.7 t -81.01 130.84 35.2 Favored 'General case' 0 N--CA 1.472 0.643 0 O-C-N 121.632 -0.668 . . . . 0.0 111.684 174.062 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 2.6 pm0 -101.8 -25.8 13.69 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.692 1.597 . . . . 0.0 112.203 169.08 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 87.3 m-20 -77.41 -38.08 50.52 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 124.456 1.103 . . . . 0.0 112.924 179.781 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 8.7 mtt 51.46 36.01 15.69 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.694 1.597 . . . . 0.0 115.131 175.284 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -131.74 146.55 52.22 Favored 'General case' 0 CA--C 1.54 0.558 0 N-CA-C 114.057 1.132 . . . . 0.0 114.057 -173.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 2.8 t80 -153.98 179.66 8.7 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 125.749 1.62 . . . . 0.0 110.38 173.57 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 22.9 ttmm -135.05 138.16 43.62 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 124.434 1.094 . . . . 0.0 113.038 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 26.4 t -71.62 116.75 50.94 Favored Pre-proline 0 CA--C 1.539 0.544 0 C-N-CA 126.301 1.84 . . . . 0.0 110.198 170.271 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo -72.65 -17.68 26.04 Favored 'Trans proline' 0 CA--C 1.543 0.951 0 C-N-CA 122.859 2.373 . . . . 0.0 113.581 176.3 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 90.7 mt -73.02 -55.35 13.09 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 CA-C-N 119.803 1.183 . . . . 0.0 110.953 -178.547 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 14.9 p -103.35 2.76 34.44 Favored 'General case' 0 CA--C 1.553 1.062 0 C-N-CA 124.566 1.146 . . . . 0.0 113.494 -179.242 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 568' ' ' LYS . . . . . . . . . . . . 0.335 64.1 pttt 56.0 42.92 28.01 Favored 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 127.083 2.153 . . . . 0.0 113.608 -177.63 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 69.8 mm-40 -119.6 137.81 53.63 Favored 'General case' 0 N--CA 1.483 1.207 0 N-CA-C 114.803 1.409 . . . . 0.0 114.803 -174.666 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 49.9 m -74.37 140.55 44.86 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 124.679 1.192 . . . . 0.0 112.992 -178.214 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -114.84 145.51 20.5 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.617 0 C-N-CA 126.576 1.95 . . . . 0.0 110.86 168.948 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 44.6 p -133.31 141.53 48.01 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.601 1.16 . . . . 0.0 111.794 178.752 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -70.6 147.32 43.47 Favored Glycine 0 CA--C 1.534 1.236 0 C-N-CA 124.709 1.147 . . . . 0.0 113.615 -179.637 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 71.8 t -130.03 141.98 44.98 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 C-N-CA 125.318 1.447 . . . . 0.0 111.139 -179.737 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 62.0 t80 -65.41 131.33 46.16 Favored 'General case' 0 CA--C 1.544 0.742 0 CA-C-O 121.828 0.823 . . . . 0.0 112.725 -175.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 49.9 t0 -96.03 99.39 11.15 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 126.723 2.009 . . . . 0.0 111.391 174.061 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 69.0 mt-10 -66.34 -21.79 66.25 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 124.746 1.219 . . . . 0.0 113.958 179.776 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 36.7 tp10 -72.96 -34.66 66.64 Favored 'General case' 0 CA--C 1.542 0.645 0 O-C-N 120.499 -1.376 . . . . 0.0 113.103 -176.54 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 63.7 m -124.13 -13.13 7.33 Favored 'General case' 0 N--CA 1.474 0.749 0 N-CA-C 114.853 1.427 . . . . 0.0 114.853 -178.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 84.08 33.14 21.57 Favored Glycine 0 CA--C 1.531 1.055 0 C-N-CA 124.309 0.957 . . . . 0.0 113.209 176.209 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -121.83 -162.63 1.0 Allowed 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 125.14 1.376 . . . . 0.0 109.769 -178.488 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 62.8 m95 -129.18 155.08 46.09 Favored 'General case' 0 CA--C 1.533 0.302 0 O-C-N 121.116 -0.99 . . . . 0.0 111.465 175.431 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 16.2 m -139.37 134.03 39.54 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 C-N-CA 124.788 1.235 . . . . 0.0 112.933 -173.86 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 1.0 OUTLIER -86.46 96.91 10.2 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 126.618 1.967 . . . . 0.0 108.331 169.748 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 67.3 mttm -74.34 149.75 40.44 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 124.674 1.19 . . . . 0.0 111.841 -179.838 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 64.79 0.62 1.2 Allowed 'General case' 0 CA--C 1.56 1.331 0 C-N-CA 126.805 2.042 . . . . 0.0 113.895 -172.269 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 54.0 m -94.91 149.05 21.66 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 125.622 1.569 . . . . 0.0 113.658 -171.186 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 14.4 tt -136.65 146.39 28.72 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.63 0 C-N-CA 127.834 2.454 . . . . 0.0 110.262 172.863 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 73.3 tt0 -108.3 126.87 53.33 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 124.632 1.173 . . . . 0.0 110.908 170.74 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 7.7 p -154.12 135.95 5.92 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 C-N-CA 124.951 1.3 . . . . 0.0 111.199 -177.441 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 71.9 m-20 52.54 38.28 25.27 Favored 'General case' 0 CA--C 1.552 1.057 0 C-N-CA 125.177 1.391 . . . . 0.0 113.666 -179.43 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 76.54 11.04 85.54 Favored Glycine 0 CA--C 1.535 1.305 0 C-N-CA 125.33 1.443 . . . . 0.0 115.62 178.438 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 56.8 mtmt -133.01 155.13 49.75 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 125.653 1.581 . . . . 0.0 111.907 -178.312 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 69.9 m-85 -92.48 147.2 23.09 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 124.271 1.028 . . . . 0.0 112.321 175.234 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 90.1 m-85 -152.21 171.12 18.43 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 126.554 1.942 . . . . 0.0 110.241 -174.432 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 596' ' ' HIS . . . . . . . . . . . . . 17.4 m80 -89.8 140.56 29.47 Favored 'General case' 0 N--CA 1.471 0.581 0 O-C-N 121.31 -0.869 . . . . 0.0 109.273 167.54 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 67.6 m -60.14 -41.72 93.31 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 123.391 0.676 . . . . 0.0 112.113 176.724 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 5.6 p -64.81 -42.73 94.77 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 124.977 1.311 . . . . 0.0 112.575 175.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 599' ' ' CYS . . . . . . . . . . . . . 90.8 m -65.57 -51.65 58.23 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 124.283 1.033 . . . . 0.0 111.108 177.147 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 83.7 t80 -57.84 -35.1 70.44 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 123.718 0.807 . . . . 0.0 112.608 178.064 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 1.7 m-70 -64.94 -21.63 66.86 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 114.352 1.241 . . . . 0.0 114.352 174.465 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 74.7 mt-10 -90.52 -34.15 15.66 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 119.369 0.986 . . . . 0.0 113.275 171.272 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 69.0 p . . . . . 0 N--CA 1.482 1.127 0 N-CA-C 114.542 1.312 . . . . 0.0 114.542 -175.057 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 30.1 mm . . . . . 0 CA--C 1.539 0.548 0 N-CA-C 110.519 -0.178 . . . . 0.0 110.519 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -74.31 -22.41 59.28 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 124.216 1.007 . . . . 0.0 113.219 176.416 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -72.61 -13.58 77.9 Favored Glycine 0 CA--C 1.537 1.416 0 C-N-CA 124.709 1.147 . . . . 0.0 115.085 174.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -69.08 143.05 54.33 Favored 'General case' 0 N--CA 1.476 0.826 0 CA-C-N 118.272 1.036 . . . . 0.0 111.909 176.882 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 54.8 p90 -151.74 164.5 36.86 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 124.545 1.138 . . . . 0.0 112.634 173.718 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 10.6 m -130.48 139.99 49.94 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 C-N-CA 126.491 1.917 . . . . 0.0 109.07 169.613 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 9.2 p -72.29 136.95 24.54 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.048 0 O-C-N 120.871 -1.143 . . . . 0.0 111.151 -175.781 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 11.9 t -84.06 120.06 74.24 Favored Pre-proline 0 N--CA 1.469 0.519 0 C-N-CA 124.122 0.969 . . . . 0.0 108.534 171.264 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 90.6 Cg_endo -73.56 156.76 49.44 Favored 'Trans proline' 0 CA--C 1.539 0.745 0 C-N-CA 122.724 2.283 . . . . 0.0 112.278 177.782 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -61.26 -24.17 66.19 Favored 'General case' 0 N--CA 1.482 1.168 0 O-C-N 121.473 -0.767 . . . . 0.0 112.656 175.069 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 67.8 p -74.08 -19.91 60.45 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 125.433 1.493 . . . . 0.0 114.136 176.181 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 4.1 m -75.54 95.39 3.31 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 119.073 0.851 . . . . 0.0 110.4 172.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 29.0 mt-30 -58.0 -43.17 86.46 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 125.457 1.503 . . . . 0.0 114.022 -169.846 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 63.6 m-20 -94.99 -12.04 27.4 Favored 'General case' 0 CA--C 1.545 0.786 0 N-CA-C 114.185 1.18 . . . . 0.0 114.185 -176.412 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 7.8 mtt 51.4 31.19 6.95 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 126.135 1.774 . . . . 0.0 113.787 -170.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -128.08 148.78 50.58 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.294 1.437 . . . . 0.0 112.256 -178.076 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -150.99 171.84 16.65 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 125.256 1.422 . . . . 0.0 109.761 176.186 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 563' ' ' LYS . . . . . . . . . . . . 0.292 0.0 OUTLIER -117.84 156.84 27.68 Favored 'General case' 0 N--CA 1.479 0.979 0 N-CA-C 114.715 1.376 . . . . 0.0 114.715 178.795 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 23.9 t -98.3 109.09 50.9 Favored Pre-proline 0 CA--C 1.539 0.519 0 C-N-CA 127.897 2.479 . . . . 0.0 109.999 169.803 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -62.33 -19.63 67.73 Favored 'Trans proline' 0 C--N 1.352 0.724 0 C-N-CA 123.148 2.565 . . . . 0.0 115.206 174.503 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 90.1 mt -73.78 -61.51 1.67 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.908 0 CA-C-N 119.455 1.025 . . . . 0.0 110.74 -178.756 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 15.7 p -96.19 -0.39 50.02 Favored 'General case' 0 CA--C 1.548 0.888 0 N-CA-C 114.126 1.158 . . . . 0.0 114.126 -177.335 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 568' ' ' LYS . . . . . . . . . . . . . 47.0 mmtm 58.59 46.14 15.14 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 125.904 1.682 . . . . 0.0 112.053 -176.684 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 53.2 mm-40 -117.8 161.12 20.24 Favored 'General case' 0 N--CA 1.484 1.249 0 N-CA-C 113.783 1.031 . . . . 0.0 113.783 -177.057 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 58.4 m -102.82 127.58 49.94 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 124.012 0.925 . . . . 0.0 112.442 -179.134 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 3.1 m -91.46 149.29 4.14 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 C-N-CA 124.651 1.18 . . . . 0.0 110.556 167.901 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 43.8 p -132.45 142.06 49.09 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 125.111 1.364 . . . . 0.0 110.585 174.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -67.25 152.49 52.73 Favored Glycine 0 CA--C 1.528 0.891 0 C-N-CA 124.092 0.853 . . . . 0.0 113.489 179.195 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 57.4 t -133.65 133.1 57.23 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.858 0 C-N-CA 125.253 1.421 . . . . 0.0 111.629 176.822 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 44.8 t80 -70.12 128.18 35.39 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 114.052 1.13 . . . . 0.0 114.052 -173.051 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 13.4 t0 -98.02 114.05 26.09 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 125.365 1.466 . . . . 0.0 109.02 168.409 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 9.7 mp0 -72.83 -27.24 61.83 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 114.242 1.201 . . . . 0.0 114.242 -173.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -83.26 -44.38 15.02 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 123.904 0.881 . . . . 0.0 112.058 179.869 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 59.8 m -71.85 -30.22 65.22 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.21 0.604 . . . . 0.0 112.249 171.884 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 77.4 26.37 61.56 Favored Glycine 0 CA--C 1.534 1.227 0 C-N-CA 124.797 1.189 . . . . 0.0 112.978 -177.905 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 55.0 mt-10 -142.43 150.94 41.26 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 125.598 1.559 . . . . 0.0 110.434 -171.49 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 43.3 m95 -84.67 151.78 24.22 Favored 'General case' 0 CA--C 1.543 0.677 0 O-C-N 121.204 -0.935 . . . . 0.0 111.23 179.629 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 17.3 m -134.39 139.35 48.15 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.31 0 C-N-CA 125.227 1.411 . . . . 0.0 112.792 -176.482 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 2.6 m0 -89.64 100.8 13.53 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 126.399 1.88 . . . . 0.0 107.855 171.27 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 53.2 mtmt -78.76 157.96 28.37 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 124.395 1.078 . . . . 0.0 112.024 179.809 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 9.1 t30 54.58 30.7 13.64 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 125.265 1.426 . . . . 0.0 113.047 -174.227 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 86.1 m -122.52 148.12 45.55 Favored 'General case' 0 N--CA 1.48 1.036 0 O-C-N 121.0 -1.063 . . . . 0.0 112.15 -169.774 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 15.6 tt -138.25 142.35 35.61 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 C-N-CA 127.313 2.245 . . . . 0.0 110.973 178.664 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 77.8 tt0 -102.96 127.27 50.25 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.457 1.103 . . . . 0.0 110.224 169.388 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 7.6 p -152.67 133.24 4.28 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 C-N-CA 125.113 1.365 . . . . 0.0 110.819 -178.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 74.9 m-20 53.96 41.71 31.93 Favored 'General case' 0 CA--C 1.551 0.986 0 C-N-CA 124.801 1.24 . . . . 0.0 113.104 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 73.7 11.26 80.61 Favored Glycine 0 CA--C 1.536 1.396 0 C-N-CA 124.813 1.197 . . . . 0.0 115.551 179.141 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 36.3 mtmm -134.96 156.13 49.55 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 126.341 1.857 . . . . 0.0 111.849 -173.418 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 75.9 m-85 -100.03 146.13 27.1 Favored 'General case' 0 N--CA 1.464 0.25 0 C-N-CA 124.364 1.066 . . . . 0.0 113.282 179.412 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 86.5 m-85 -151.76 165.9 33.0 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 126.592 1.957 . . . . 0.0 110.366 -173.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 596' ' ' HIS . . . . . . . . . . . . . 20.7 m80 -81.09 142.97 32.78 Favored 'General case' 0 N--CA 1.468 0.44 0 O-C-N 121.381 -0.824 . . . . 0.0 109.491 168.77 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 66.9 p -60.88 -44.79 96.59 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 123.919 0.888 . . . . 0.0 111.681 176.942 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 18.7 p -63.99 -44.7 91.89 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 125.023 1.329 . . . . 0.0 112.93 175.322 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 599' ' ' CYS . . . . . . . . . . . . . 97.5 m -60.97 -45.47 94.63 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.587 1.155 . . . . 0.0 111.792 178.605 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 84.2 t80 -72.95 -32.17 65.07 Favored 'General case' 0 CA--C 1.546 0.804 0 N-CA-C 113.382 0.882 . . . . 0.0 113.382 177.556 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 57.4 t-80 -75.16 -81.67 0.07 Allowed 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 114.706 1.373 . . . . 0.0 114.706 -174.178 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -95.93 -6.96 37.89 Favored 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 113.616 0.969 . . . . 0.0 113.616 -174.253 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 1.5 m . . . . . 0 N--CA 1.478 0.944 0 C-N-CA 124.585 1.154 . . . . 0.0 111.996 -177.975 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 11.2 mm . . . . . 0 CA--C 1.541 0.599 0 N-CA-C 110.297 -0.26 . . . . 0.0 110.297 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 79.7 ttt180 -65.94 -28.92 69.28 Favored 'General case' 0 N--CA 1.478 0.927 0 O-C-N 121.125 -0.984 . . . . 0.0 112.173 -179.202 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -71.96 -7.55 66.65 Favored Glycine 0 CA--C 1.542 1.734 0 C-N-CA 124.706 1.146 . . . . 0.0 115.428 175.061 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 41.8 mmtm -70.3 144.66 51.67 Favored 'General case' 0 N--CA 1.479 0.996 0 CA-C-N 119.771 1.786 . . . . 0.0 111.227 177.858 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 40.2 p90 -149.29 166.47 28.86 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 113.937 1.088 . . . . 0.0 113.937 178.198 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 4.8 m -136.74 138.84 45.8 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.841 0 C-N-CA 126.801 2.04 . . . . 0.0 109.73 174.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 44.0 t -70.29 133.98 30.88 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 O-C-N 121.084 -1.01 . . . . 0.0 110.998 -177.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 3.1 t -91.88 124.31 60.63 Favored Pre-proline 0 N--CA 1.471 0.591 0 C-N-CA 124.273 1.029 . . . . 0.0 111.639 178.198 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 62.1 Cg_endo -80.48 152.46 20.32 Favored 'Trans proline' 0 CA--C 1.538 0.714 0 C-N-CA 123.274 2.649 . . . . 0.0 111.638 169.893 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -66.77 -18.32 65.31 Favored 'General case' 0 CA--C 1.548 0.88 0 O-C-N 120.401 -1.437 . . . . 0.0 113.103 175.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -71.73 -22.65 61.6 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 124.877 1.271 . . . . 0.0 113.44 173.204 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 9.6 m -73.51 121.63 20.9 Favored 'General case' 0 N--CA 1.473 0.702 0 O-C-N 121.497 -0.752 . . . . 0.0 110.328 170.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 55.2 tp60 -53.41 116.09 2.26 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 125.077 1.351 . . . . 0.0 112.484 -168.514 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 53.31 20.95 2.1 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 126.559 1.944 . . . . 0.0 114.822 177.789 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 28.6 mtt 53.47 33.08 15.27 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 125.522 1.529 . . . . 0.0 113.443 -168.834 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -126.95 134.65 50.36 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 125.031 1.332 . . . . 0.0 112.544 -177.053 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 41.6 t80 -148.21 161.33 41.69 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 124.861 1.264 . . . . 0.0 110.041 174.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 3.5 ttmp? -112.67 131.26 55.73 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 123.827 0.851 . . . . 0.0 113.001 -171.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 22.6 t -68.11 111.77 8.8 Favored Pre-proline 0 CA--C 1.541 0.633 0 C-N-CA 126.064 1.745 . . . . 0.0 109.479 168.644 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -69.83 -17.34 37.32 Favored 'Trans proline' 0 CA--C 1.54 0.815 0 C-N-CA 122.515 2.143 . . . . 0.0 113.349 177.691 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 86.8 mt -70.28 -51.54 37.63 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.672 0 C-N-CA 124.593 1.157 . . . . 0.0 110.898 -177.706 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 14.6 p -110.75 -0.86 16.89 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 124.729 1.212 . . . . 0.0 114.071 -178.877 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 568' ' ' LYS . . . . . . . . . . . . . 34.1 mmtp 60.64 45.86 9.88 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 126.604 1.962 . . . . 0.0 113.352 -177.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 74.7 mt-10 -120.79 138.67 53.91 Favored 'General case' 0 N--CA 1.481 1.078 0 N-CA-C 113.746 1.017 . . . . 0.0 113.746 -175.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 97.1 m -83.77 121.48 27.36 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.256 0.622 . . . . 0.0 112.181 -179.234 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 1.7 m -88.11 143.65 10.82 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 C-N-CA 125.22 1.408 . . . . 0.0 110.364 168.172 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 69.1 p -124.62 142.77 51.13 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 124.971 1.309 . . . . 0.0 111.629 -179.187 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -74.97 145.55 33.8 Favored Glycine 0 CA--C 1.53 0.988 0 C-N-CA 124.302 0.953 . . . . 0.0 113.372 179.065 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 61.6 t -135.32 141.6 42.11 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.875 0 C-N-CA 125.599 1.56 . . . . 0.0 111.554 -177.336 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 62.1 t80 -70.52 127.39 32.55 Favored 'General case' 0 CA--C 1.542 0.64 0 O-C-N 121.277 -0.889 . . . . 0.0 112.976 -176.697 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 65.1 t0 -94.12 104.21 16.24 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 127.072 2.149 . . . . 0.0 109.892 170.015 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -66.89 -26.97 67.14 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.072 1.349 . . . . 0.0 114.45 -177.624 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 31.8 tp10 -78.66 -44.31 24.04 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 123.609 0.763 . . . . 0.0 111.713 -178.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 22.8 t -81.57 -35.32 30.37 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 124.903 1.281 . . . . 0.0 112.276 177.219 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 84.17 32.81 22.18 Favored Glycine 0 CA--C 1.53 1.031 0 C-N-CA 124.513 1.054 . . . . 0.0 113.468 -172.736 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 81.8 mm-40 -130.16 178.54 6.48 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.479 1.512 . . . . 0.0 110.705 -175.537 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 68.6 m95 -111.25 145.4 38.82 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 121.015 -1.053 . . . . 0.0 110.251 171.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 13.8 m -137.72 138.04 44.68 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.892 0 C-N-CA 124.985 1.314 . . . . 0.0 113.227 -172.057 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 0.8 OUTLIER -87.26 100.95 13.07 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 126.327 1.851 . . . . 0.0 107.228 169.952 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 56.7 mtmt -73.56 157.03 37.46 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 124.184 0.993 . . . . 0.0 111.253 177.093 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 55.2 33.4 20.48 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 125.307 1.443 . . . . 0.0 112.392 -176.407 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 55.2 m -130.36 147.78 52.1 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 124.71 1.204 . . . . 0.0 112.239 -169.432 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 14.7 tt -136.41 144.16 33.61 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.718 0 C-N-CA 126.978 2.111 . . . . 0.0 111.096 178.543 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -105.89 135.79 46.7 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 125.243 1.417 . . . . 0.0 110.157 168.722 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 7.5 p -147.66 123.51 2.64 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.619 0 C-N-CA 124.289 1.036 . . . . 0.0 111.006 173.88 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 69.9 m-20 51.08 36.58 15.78 Favored 'General case' 0 CA--C 1.551 1.003 0 C-N-CA 125.472 1.509 . . . . 0.0 114.245 175.402 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 89.15 -9.19 77.82 Favored Glycine 0 CA--C 1.536 1.405 0 C-N-CA 125.32 1.438 . . . . 0.0 115.633 -179.221 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 63.4 mttp -95.87 153.77 17.58 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 125.578 1.551 . . . . 0.0 111.78 176.329 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 69.1 m-85 -113.38 142.75 45.5 Favored 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 125.0 1.32 . . . . 0.0 112.259 174.485 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 16.3 m-85 -149.18 159.01 44.63 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 126.307 1.843 . . . . 0.0 110.6 -173.569 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 596' ' ' HIS . . . . . . . . . . . . . 11.8 m80 -71.31 139.13 49.81 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 106.539 -1.652 . . . . 0.0 106.539 165.555 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 72.8 p -59.3 -43.0 92.65 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 122.995 0.518 . . . . 0.0 111.935 178.603 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 14.1 p -71.59 -33.41 69.01 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 125.362 1.465 . . . . 0.0 113.693 178.144 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 599' ' ' CYS . . . . . . . . . . . . . 99.3 m -66.68 -52.46 44.57 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.657 0.783 . . . . 0.0 111.021 172.495 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 66.1 t80 -57.53 -40.67 79.32 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 123.183 0.593 . . . . 0.0 111.955 176.73 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 69.8 t60 -56.36 -46.84 79.82 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.837 1.255 . . . . 0.0 113.872 175.384 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -77.76 -23.75 49.15 Favored 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 114.044 1.127 . . . . 0.0 114.044 174.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 68.4 m . . . . . 0 N--CA 1.48 1.047 0 C-N-CA 124.939 1.296 . . . . 0.0 112.714 179.227 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 18.5 mm . . . . . 0 N--CA 1.476 0.831 0 CA-C-O 120.612 0.244 . . . . 0.0 111.454 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 45.0 ttt180 -61.34 -21.66 64.21 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.518 1.127 . . . . 0.0 112.879 179.442 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -71.79 -11.67 73.75 Favored Glycine 0 CA--C 1.539 1.569 0 C-N-CA 124.643 1.116 . . . . 0.0 115.251 176.03 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -69.76 146.32 51.55 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-N 119.201 1.501 . . . . 0.0 112.18 173.417 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 47.6 p90 -156.5 166.52 33.18 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 124.955 1.302 . . . . 0.0 111.772 171.59 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 2.5 m -128.93 133.5 66.0 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 C-N-CA 124.618 1.167 . . . . 0.0 109.745 170.479 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 53.3 t -68.23 132.41 32.78 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 O-C-N 121.26 -0.9 . . . . 0.0 110.113 -179.796 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 22.4 t -78.97 119.08 75.94 Favored Pre-proline 0 N--CA 1.472 0.651 0 CA-C-O 118.483 -0.77 . . . . 0.0 110.588 -179.239 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 65.3 Cg_endo -78.82 156.24 27.24 Favored 'Trans proline' 0 CA--C 1.537 0.643 0 C-N-CA 123.126 2.551 . . . . 0.0 112.15 176.84 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -67.47 -17.81 64.83 Favored 'General case' 0 N--CA 1.474 0.738 0 O-C-N 121.486 -0.759 . . . . 0.0 112.884 176.885 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 66.8 p -74.06 -22.99 59.31 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 125.02 1.328 . . . . 0.0 113.493 173.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 24.7 m -80.2 112.09 17.18 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 123.997 0.919 . . . . 0.0 111.683 175.258 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -62.08 136.22 57.85 Favored 'General case' 0 CA--C 1.546 0.824 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 -173.667 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 33.8 m-20 53.92 15.32 0.83 Allowed 'General case' 0 CA--C 1.553 1.073 0 C-N-CA 126.733 2.013 . . . . 0.0 115.418 176.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 18.9 mtt 51.35 31.93 7.78 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 125.672 1.589 . . . . 0.0 114.659 -171.494 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -123.95 142.67 50.95 Favored 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 113.851 1.056 . . . . 0.0 113.851 -174.526 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 6.5 t80 -153.91 -179.97 8.35 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 125.919 1.688 . . . . 0.0 109.963 173.378 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 18.1 ttmm -130.56 152.91 49.42 Favored 'General case' 0 N--CA 1.48 1.032 0 O-C-N 120.628 -1.295 . . . . 0.0 113.385 -175.273 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 19.2 t -95.9 107.0 31.5 Favored Pre-proline 0 CA--C 1.543 0.71 0 C-N-CA 127.865 2.466 . . . . 0.0 110.307 170.865 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_exo -62.38 -20.45 70.37 Favored 'Trans proline' 0 CA--C 1.546 1.086 0 C-N-CA 122.268 1.979 . . . . 0.0 115.736 174.71 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 88.7 mt -69.38 -52.26 34.51 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 C-N-CA 124.266 1.026 . . . . 0.0 111.35 -177.205 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 14.9 p -108.62 -0.71 20.06 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 124.328 1.051 . . . . 0.0 113.717 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 568' ' ' LYS . . . . . . . . . . . . . 95.1 mttt 59.82 44.43 13.88 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 126.966 2.106 . . . . 0.0 113.151 -177.571 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 64.8 mt-10 -112.0 138.93 47.97 Favored 'General case' 0 N--CA 1.479 0.995 0 N-CA-C 113.488 0.922 . . . . 0.0 113.488 -177.697 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 57.7 m -85.71 121.24 28.1 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 123.216 0.606 . . . . 0.0 111.037 177.778 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 3.8 m -88.4 144.15 9.76 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 C-N-CA 125.442 1.497 . . . . 0.0 110.502 170.414 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 74.6 p -128.94 144.81 51.29 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.976 1.311 . . . . 0.0 110.799 174.274 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -72.03 141.06 30.95 Favored Glycine 0 CA--C 1.525 0.677 0 C-N-CA 124.152 0.882 . . . . 0.0 112.547 -178.138 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 33.3 m -132.63 139.72 49.18 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 C-N-CA 124.497 1.119 . . . . 0.0 112.001 -178.545 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 79.2 t80 -75.32 113.69 12.99 Favored 'General case' 0 CA--C 1.54 0.589 0 O-C-N 121.4 -0.813 . . . . 0.0 111.284 179.581 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -82.3 118.21 22.97 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.371 1.068 . . . . 0.0 110.447 170.67 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 11.6 mp0 -73.87 -28.11 61.41 Favored 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 114.017 1.117 . . . . 0.0 114.017 -173.335 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 32.8 tp10 -81.52 -41.92 20.97 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.228 1.011 . . . . 0.0 111.914 -179.41 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 36.0 t -74.62 -35.88 62.93 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 125.016 1.326 . . . . 0.0 112.015 173.072 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 80.91 33.1 30.79 Favored Glycine 0 CA--C 1.534 1.246 0 C-N-CA 124.491 1.043 . . . . 0.0 113.053 -177.042 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 69.9 mm-40 -144.93 149.95 36.15 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 125.138 1.375 . . . . 0.0 111.716 -171.518 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 84.5 m95 -76.89 134.5 38.96 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 122.723 0.409 . . . . 0.0 110.555 170.032 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 8.1 m -139.41 145.05 27.71 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 C-N-CA 124.658 1.183 . . . . 0.0 113.007 -168.765 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 2.8 m0 -93.81 97.6 10.52 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 106.715 -1.587 . . . . 0.0 106.715 167.623 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 61.6 mttm -74.32 145.07 44.21 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 124.447 1.099 . . . . 0.0 111.959 -175.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 62.9 t30 52.16 37.12 20.91 Favored 'General case' 0 CA--C 1.551 0.994 0 C-N-CA 126.33 1.852 . . . . 0.0 113.201 -170.588 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 88.4 m -119.18 147.13 44.55 Favored 'General case' 0 N--CA 1.481 1.108 0 O-C-N 120.67 -1.269 . . . . 0.0 112.252 -176.148 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 13.2 tt -136.66 145.65 29.94 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.64 0 C-N-CA 127.888 2.475 . . . . 0.0 110.719 -178.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 73.5 tt0 -105.7 125.68 51.27 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.569 1.148 . . . . 0.0 110.564 169.793 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 8.3 p -158.93 145.84 7.5 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 C-N-CA 124.997 1.319 . . . . 0.0 110.655 179.876 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 53.9 t30 53.01 38.73 28.04 Favored 'General case' 0 CA--C 1.554 1.111 0 C-N-CA 124.431 1.092 . . . . 0.0 112.55 -177.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 65.95 14.89 61.81 Favored Glycine 0 CA--C 1.534 1.257 0 C-N-CA 125.51 1.529 . . . . 0.0 115.971 -179.844 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 35.8 mtmm -134.83 159.95 39.76 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 126.349 1.86 . . . . 0.0 110.938 -177.278 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 70.4 m-85 -91.03 149.7 21.73 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-O 121.979 0.895 . . . . 0.0 112.08 169.866 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 9.8 m-85 -145.9 165.31 29.31 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 127.283 2.233 . . . . 0.0 109.387 177.576 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 596' ' ' HIS . . . . . . . . . . . . . 26.7 m80 -77.94 141.88 38.73 Favored 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 108.161 -1.052 . . . . 0.0 108.161 166.102 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 8.4 t -65.94 -41.73 90.94 Favored 'General case' 0 N--CA 1.466 0.353 0 O-C-N 121.805 -0.559 . . . . 0.0 112.018 -177.186 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 22.3 p -64.72 -42.64 95.09 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 123.608 0.763 . . . . 0.0 112.683 173.666 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 599' ' ' CYS . . . . . . . . . . . . . 64.2 m -56.14 -58.27 8.66 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.589 1.155 . . . . 0.0 110.824 174.617 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 76.5 t80 -58.69 -46.77 86.51 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.414 0.686 . . . . 0.0 112.456 179.793 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 33.9 t-80 -58.73 -47.21 85.39 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 124.102 0.961 . . . . 0.0 113.129 -176.662 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 35.5 tp10 -77.29 -30.5 54.23 Favored 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 112.72 0.637 . . . . 0.0 112.72 -179.902 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 98.6 m . . . . . 0 N--CA 1.479 1.004 0 C-N-CA 123.761 0.825 . . . . 0.0 112.981 -176.787 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 33.9 mm . . . . . 0 CA--C 1.542 0.658 0 N-CA-C 110.847 -0.057 . . . . 0.0 110.847 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 19.0 tpp180 -68.14 -34.62 76.7 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 124.333 1.053 . . . . 0.0 111.767 175.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -72.61 -6.14 65.73 Favored Glycine 0 CA--C 1.537 1.424 0 C-N-CA 125.76 1.648 . . . . 0.0 115.645 177.176 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 73.4 mmtt -76.67 125.84 29.94 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-N 119.576 1.688 . . . . 0.0 110.289 171.897 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 39.5 p90 -149.29 162.89 39.15 Favored 'General case' 0 C--O 1.237 0.404 0 N-CA-C 113.277 0.843 . . . . 0.0 113.277 176.619 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -135.68 138.13 48.37 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.485 0 C-N-CA 126.274 1.83 . . . . 0.0 110.422 179.044 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 76.2 t -70.54 134.92 29.18 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.939 0 C-N-CA 123.821 0.849 . . . . 0.0 110.812 -175.61 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 72.7 t -64.96 121.79 75.87 Favored Pre-proline 0 CA--C 1.544 0.719 0 C-N-CA 124.22 1.008 . . . . 0.0 108.957 173.491 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -87.0 -9.11 6.42 Favored 'Trans proline' 0 CA--C 1.536 0.586 0 C-N-CA 124.583 3.522 . . . . 0.0 114.54 -169.144 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 63.48 -24.63 0.07 Allowed 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 127.826 2.45 . . . . 0.0 114.627 -168.408 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 80.6 p -64.53 -18.91 65.26 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 124.989 1.315 . . . . 0.0 111.995 169.333 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 33.5 p -65.56 -8.24 18.86 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 126.692 1.997 . . . . 0.0 114.184 168.493 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? 68.26 -36.78 0.32 Allowed 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 128.408 2.683 . . . . 0.0 116.644 169.751 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 28.9 t0 -125.54 14.24 8.17 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 125.167 1.387 . . . . 0.0 113.45 178.319 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 80.2 mtp 56.63 22.48 6.77 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 126.276 1.83 . . . . 0.0 114.368 -179.49 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -133.3 152.51 51.93 Favored 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 125.818 1.647 . . . . 0.0 112.012 -170.089 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 10.5 m-85 -148.82 156.43 42.33 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 125.527 1.531 . . . . 0.0 111.823 171.495 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 47.2 tttp -85.81 153.01 22.57 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 124.385 1.074 . . . . 0.0 113.248 -178.634 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 13.7 t -104.89 101.78 31.49 Favored Pre-proline 0 CA--C 1.547 0.831 0 C-N-CA 126.559 1.943 . . . . 0.0 109.128 165.017 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -61.33 -21.16 71.02 Favored 'Trans proline' 0 CA--C 1.541 0.825 0 C-N-CA 122.726 2.284 . . . . 0.0 115.496 176.76 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 89.3 mt -72.87 -58.07 5.71 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 C-N-CA 124.495 1.118 . . . . 0.0 111.658 -177.691 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 14.4 p -98.12 2.62 48.77 Favored 'General case' 0 CA--C 1.552 1.055 0 C-N-CA 123.977 0.911 . . . . 0.0 113.346 179.406 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 568' ' ' LYS . . . . . . . . . . . . 0.326 20.1 ptpt 54.85 42.85 30.81 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 127.566 2.346 . . . . 0.0 113.434 -177.401 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 71.2 mm-40 -109.84 -177.27 3.22 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.624 0.77 . . . . 0.0 112.196 179.26 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 64.4 m -132.34 120.99 22.82 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 124.556 1.142 . . . . 0.0 110.977 178.218 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -81.74 149.77 4.73 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 C-N-CA 124.456 1.102 . . . . 0.0 110.258 168.056 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 3.4 t -149.0 155.62 41.06 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.969 0.907 . . . . 0.0 112.388 171.436 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -58.47 148.28 38.09 Favored Glycine 0 CA--C 1.534 1.251 0 C-N-CA 126.18 1.848 . . . . 0.0 116.661 -168.648 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 60.8 t -136.2 132.6 49.76 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 C-N-CA 125.691 1.596 . . . . 0.0 111.567 173.413 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 57.7 t80 -73.67 127.69 33.46 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 113.327 0.862 . . . . 0.0 113.327 -175.113 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 22.7 t0 -99.37 122.76 42.95 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 125.705 1.602 . . . . 0.0 110.45 169.237 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 64.7 mt-10 -73.55 -24.27 60.1 Favored 'General case' 0 CA--C 1.544 0.74 0 N-CA-C 113.793 1.035 . . . . 0.0 113.793 177.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -77.16 -52.48 9.2 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 119.401 1.001 . . . . 0.0 112.115 -176.234 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 89.9 p -74.42 -24.98 59.17 Favored 'General case' 0 N--CA 1.479 0.995 0 O-C-N 121.548 -0.72 . . . . 0.0 112.048 169.296 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 78.31 28.81 55.06 Favored Glycine 0 CA--C 1.536 1.403 0 C-N-CA 124.501 1.048 . . . . 0.0 113.15 -179.62 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -143.2 159.03 43.07 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.718 1.607 . . . . 0.0 112.645 -172.304 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 82.3 m95 -78.73 137.39 37.75 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.805 0.842 . . . . 0.0 111.677 176.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 19.2 m -130.0 151.28 35.62 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.762 0 C-N-CA 126.261 1.824 . . . . 0.0 112.912 -178.032 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 5.7 m0 -97.09 104.35 16.36 Favored 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 126.452 1.901 . . . . 0.0 110.553 169.321 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -70.87 148.39 47.85 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 124.221 1.009 . . . . 0.0 111.987 179.091 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 48.3 t30 50.45 45.48 26.34 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 124.855 1.262 . . . . 0.0 112.518 -179.785 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 94.2 m -130.93 145.84 52.15 Favored 'General case' 0 N--CA 1.48 1.052 0 N-CA-C 113.95 1.092 . . . . 0.0 113.95 -170.113 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 8.3 tt -143.33 151.72 16.89 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.62 0 C-N-CA 128.078 2.551 . . . . 0.0 110.477 -177.792 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 73.1 tt0 -119.03 126.8 52.55 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.338 1.455 . . . . 0.0 109.792 169.696 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 2.8 t -142.01 131.98 24.22 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 C-N-CA 126.78 2.032 . . . . 0.0 109.868 -175.795 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 16.5 m120 52.44 36.87 21.22 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 124.91 1.284 . . . . 0.0 113.931 178.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 78.67 8.93 87.47 Favored Glycine 0 CA--C 1.54 1.625 0 C-N-CA 124.796 1.189 . . . . 0.0 115.518 -179.752 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 53.0 mtmt -126.56 148.57 49.73 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 126.209 1.804 . . . . 0.0 111.431 -178.646 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 20.9 m-85 -89.58 149.12 22.99 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.167 0.987 . . . . 0.0 111.979 177.004 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 94.2 m-85 -151.34 162.85 40.18 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 125.783 1.633 . . . . 0.0 111.345 -179.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 596' ' ' HIS . . . . . . . . . . . . . 24.6 m80 -78.44 140.58 38.64 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 167.901 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 19.7 m -64.86 -39.52 93.68 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 118.36 0.527 . . . . 0.0 111.673 179.223 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 22.6 p -62.4 -46.08 90.24 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 123.721 0.808 . . . . 0.0 112.943 172.781 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 599' ' ' CYS . . . . . . . . . . . . . 94.0 m -60.04 -54.41 46.35 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 124.226 1.01 . . . . 0.0 111.312 177.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 89.7 t80 -62.32 -41.71 98.77 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.293 0.637 . . . . 0.0 112.126 -179.18 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 12.9 t-160 -61.29 -44.36 97.34 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.087 0.955 . . . . 0.0 112.388 176.348 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 25.8 tt0 -71.94 -34.39 68.98 Favored 'General case' 0 CA--C 1.545 0.788 0 N-CA-C 113.291 0.849 . . . . 0.0 113.291 178.612 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 92.1 m . . . . . 0 N--CA 1.478 0.926 0 N-CA-C 113.871 1.063 . . . . 0.0 113.871 -172.26 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 29.6 mm . . . . . 0 N--CA 1.479 1.014 0 CA-C-O 120.525 0.203 . . . . 0.0 111.333 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 19.8 ptp180 -75.43 -17.8 60.07 Favored 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 113.575 0.954 . . . . 0.0 113.575 -179.676 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -80.88 -9.57 86.13 Favored Glycine 0 CA--C 1.531 1.094 0 C-N-CA 124.77 1.176 . . . . 0.0 114.562 -179.38 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 69.3 mmtt -73.58 143.68 46.31 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 118.522 1.161 . . . . 0.0 112.221 179.581 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 40.6 p90 -159.69 167.21 28.9 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 125.292 1.437 . . . . 0.0 111.886 173.848 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 2.6 m -133.65 141.9 43.0 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.725 0 C-N-CA 125.928 1.691 . . . . 0.0 110.252 171.22 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 7.4 p -76.47 137.22 23.04 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.059 0 O-C-N 121.156 -0.965 . . . . 0.0 112.642 -170.241 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 72.5 t -75.64 125.68 88.23 Favored Pre-proline 0 N--CA 1.472 0.631 0 C-N-CA 124.475 1.11 . . . . 0.0 109.696 171.554 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_endo -78.34 142.67 19.05 Favored 'Trans proline' 0 CA--C 1.539 0.772 0 C-N-CA 122.994 2.463 . . . . 0.0 111.154 173.538 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -63.18 -17.38 62.33 Favored 'General case' 0 N--CA 1.48 1.037 0 O-C-N 121.016 -1.053 . . . . 0.0 113.063 172.36 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 11.3 m -64.93 -27.04 68.58 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 125.782 1.633 . . . . 0.0 112.71 171.481 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 29.2 t -70.6 125.86 27.99 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-N 119.12 0.873 . . . . 0.0 111.907 179.484 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 45.8 tt0 -74.99 -27.14 60.03 Favored 'General case' 0 CA--C 1.55 0.948 0 N-CA-C 112.953 0.723 . . . . 0.0 112.953 176.402 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 20.3 t0 -118.98 -11.37 9.69 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 114.328 1.233 . . . . 0.0 114.328 -172.363 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 79.8 mtp 56.98 34.85 25.58 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 125.976 1.71 . . . . 0.0 113.391 177.566 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -139.63 153.63 47.37 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 115.586 1.699 . . . . 0.0 115.586 -169.579 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 19.9 m-85 -148.18 174.3 12.12 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 128.449 2.699 . . . . 0.0 108.75 169.734 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 7.3 ttpm? -132.15 142.18 49.38 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 124.287 1.035 . . . . 0.0 113.114 -175.059 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 22.3 t -83.11 114.99 56.58 Favored Pre-proline 0 CA--C 1.546 0.819 0 C-N-CA 127.948 2.499 . . . . 0.0 111.03 172.778 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -63.5 -26.38 70.14 Favored 'Trans proline' 0 CA--C 1.538 0.705 0 C-N-CA 123.144 2.563 . . . . 0.0 114.985 173.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 89.8 mt -70.35 -55.44 14.51 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.885 0 C-N-CA 124.359 1.063 . . . . 0.0 111.552 -173.581 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 14.3 p -103.54 1.13 31.85 Favored 'General case' 0 CA--C 1.553 1.086 0 C-N-CA 124.79 1.236 . . . . 0.0 113.587 179.725 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 568' ' ' LYS . . . . . . . . . . . . . 29.6 mtpp 60.65 41.45 15.21 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 126.447 1.899 . . . . 0.0 112.448 -179.832 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 77.1 mt-10 -114.23 133.89 55.31 Favored 'General case' 0 N--CA 1.486 1.331 0 N-CA-C 114.208 1.188 . . . . 0.0 114.208 -174.033 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 89.3 m -83.58 118.43 23.8 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 124.051 0.94 . . . . 0.0 111.289 177.573 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 3.5 m -81.95 149.09 4.91 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 124.566 1.146 . . . . 0.0 110.715 168.805 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 82.3 p -133.08 156.36 47.54 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 125.504 1.522 . . . . 0.0 111.273 177.008 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -65.58 140.82 41.39 Favored Glycine 0 CA--C 1.532 1.109 0 N-CA-C 115.043 0.777 . . . . 0.0 115.043 -178.763 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 85.6 t -134.49 131.47 54.39 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 C-N-CA 125.236 1.414 . . . . 0.0 110.492 178.489 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 74.6 t80 -73.89 123.9 25.13 Favored 'General case' 0 CA--C 1.543 0.673 0 N-CA-C 113.573 0.953 . . . . 0.0 113.573 -173.731 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 54.0 t0 -92.64 114.93 27.62 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.214 1.406 . . . . 0.0 109.559 169.233 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -71.32 -27.07 63.13 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 114.062 1.134 . . . . 0.0 114.062 -175.648 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 50.1 mm-40 -88.18 -39.26 14.64 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 124.282 1.033 . . . . 0.0 112.034 -179.591 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 32.4 t -70.84 -35.01 72.24 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 122.964 0.506 . . . . 0.0 112.058 169.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 81.35 25.57 54.19 Favored Glycine 0 CA--C 1.534 1.222 0 C-N-CA 125.058 1.313 . . . . 0.0 112.921 -176.482 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 78.8 mm-40 -141.57 152.65 44.25 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.89 1.276 . . . . 0.0 111.876 -170.461 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 84.2 m95 -77.06 138.68 39.7 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 123.862 0.865 . . . . 0.0 110.757 171.584 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 23.4 m -135.24 148.72 28.63 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 C-N-CA 125.415 1.486 . . . . 0.0 113.31 -175.63 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 4.1 m0 -87.63 99.62 12.2 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 126.534 1.934 . . . . 0.0 109.169 169.694 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 32.6 mmtp -68.72 148.44 50.37 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 124.093 0.957 . . . . 0.0 111.881 -178.245 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 64.2 t30 53.63 33.43 16.47 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 125.763 1.625 . . . . 0.0 113.144 179.221 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 90.1 m -116.87 142.83 46.43 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 124.05 0.94 . . . . 0.0 112.645 -171.736 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 11.1 tt -134.94 144.91 33.29 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 C-N-CA 127.71 2.404 . . . . 0.0 110.116 -179.638 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 73.6 tt0 -112.18 136.99 50.89 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 124.683 1.193 . . . . 0.0 110.713 171.272 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 12.7 p -148.56 136.12 13.97 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 C-N-CA 124.421 1.088 . . . . 0.0 110.925 172.268 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 66.0 t30 51.22 37.21 17.87 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 125.038 1.335 . . . . 0.0 113.537 177.761 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 78.1 8.3 87.44 Favored Glycine 0 CA--C 1.537 1.424 0 C-N-CA 124.829 1.204 . . . . 0.0 116.086 -179.279 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -122.94 149.61 44.04 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 125.92 1.688 . . . . 0.0 111.879 -178.147 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 72.6 m-85 -98.69 147.12 25.17 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.633 1.173 . . . . 0.0 113.176 -179.665 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 98.6 m-85 -150.85 168.89 23.1 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 126.551 1.94 . . . . 0.0 110.706 179.664 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 596' ' ' HIS . . . . . . . . . . . . . 22.8 m80 -86.17 144.17 27.62 Favored 'General case' 0 N--CA 1.471 0.605 0 O-C-N 121.288 -0.882 . . . . 0.0 110.08 168.057 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 15.6 m -65.35 -43.54 90.55 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 123.42 0.688 . . . . 0.0 111.969 179.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 22.2 p -64.64 -37.69 88.44 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 124.013 0.925 . . . . 0.0 112.966 174.29 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 599' ' ' CYS . . . . . . . . . . . . . 89.6 m -65.86 -59.76 3.54 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.135 0.974 . . . . 0.0 110.965 176.211 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 75.8 t80 -59.13 -38.39 79.52 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.169 0.988 . . . . 0.0 113.481 -175.245 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 76.6 t60 -56.69 -58.3 8.69 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 114.712 1.375 . . . . 0.0 114.712 -173.198 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 15.2 tt0 -98.14 -10.87 23.5 Favored 'General case' 0 CA--C 1.545 0.767 0 N-CA-C 113.637 0.977 . . . . 0.0 113.637 -174.387 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 98.6 m . . . . . 0 N--CA 1.485 1.276 0 O-C-N 121.157 -0.964 . . . . 0.0 112.242 179.42 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 16.7 mm . . . . . 0 CA--C 1.539 0.554 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 7.3 tmm_? -66.37 -36.35 82.65 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 124.111 0.964 . . . . 0.0 111.39 178.919 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -67.15 -6.4 39.02 Favored Glycine 0 CA--C 1.535 1.307 0 C-N-CA 125.704 1.621 . . . . 0.0 116.561 175.801 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt -70.95 134.37 47.14 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-N 119.754 1.777 . . . . 0.0 110.991 171.494 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 41.6 p90 -148.49 166.74 27.29 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 114.443 1.275 . . . . 0.0 114.443 179.697 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -136.91 138.99 45.4 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 C-N-CA 126.776 2.03 . . . . 0.0 109.241 173.722 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 83.8 t -70.48 132.02 33.67 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.994 0 O-C-N 121.043 -1.036 . . . . 0.0 110.908 -174.701 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 87.3 t -71.72 124.87 91.55 Favored Pre-proline 0 CA--C 1.541 0.629 0 C-N-CA 125.331 1.453 . . . . 0.0 109.963 175.268 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 95.5 Cg_endo -78.87 152.21 24.92 Favored 'Trans proline' 0 C--N 1.349 0.567 0 C-N-CA 123.036 2.49 . . . . 0.0 112.19 177.293 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 56.1 mt-10 -62.54 -21.67 65.74 Favored 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 113.215 0.82 . . . . 0.0 113.215 174.001 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 67.8 p -78.61 -11.85 59.99 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 125.89 1.676 . . . . 0.0 113.882 176.104 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 88.5 p -63.7 144.26 57.17 Favored 'General case' 0 N--CA 1.48 1.032 0 CA-C-N 119.242 0.928 . . . . 0.0 112.756 178.062 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 64.5 mt-30 -83.12 118.62 23.7 Favored 'General case' 0 N--CA 1.467 0.404 0 O-C-N 121.449 -0.782 . . . . 0.0 109.287 169.657 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 38.0 m-20 52.15 24.31 2.7 Favored 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 126.415 1.886 . . . . 0.0 115.197 177.47 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 8.9 mtt 54.75 36.21 25.81 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.97 1.308 . . . . 0.0 113.65 -176.453 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -125.03 147.09 49.13 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 114.368 1.247 . . . . 0.0 114.368 -171.491 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 6.5 t80 -155.48 166.4 33.66 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 125.611 1.564 . . . . 0.0 111.084 172.193 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 39.5 ttmt -107.61 148.7 28.97 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 124.907 1.283 . . . . 0.0 114.352 -171.129 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 33.9 t -95.15 110.45 50.28 Favored Pre-proline 0 CA--C 1.543 0.709 0 C-N-CA 128.384 2.674 . . . . 0.0 110.033 167.905 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -64.66 -21.7 65.05 Favored 'Trans proline' 0 CA--C 1.538 0.701 0 C-N-CA 123.037 2.491 . . . . 0.0 115.425 177.649 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 85.0 mt -70.95 -55.46 13.99 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.928 0 C-N-CA 124.025 0.93 . . . . 0.0 110.873 -177.436 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 14.7 p -103.38 0.1 30.83 Favored 'General case' 0 CA--C 1.552 1.052 0 N-CA-C 113.909 1.078 . . . . 0.0 113.909 -178.251 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 568' ' ' LYS . . . . . . . . . . . . 0.332 25.0 pttm 55.32 46.1 24.18 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 127.775 2.43 . . . . 0.0 113.419 -175.481 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 69.6 mm-40 -121.16 150.15 41.72 Favored 'General case' 0 N--CA 1.483 1.176 0 N-CA-C 113.715 1.006 . . . . 0.0 113.715 -175.583 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 89.1 m -93.46 120.79 34.16 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 124.108 0.963 . . . . 0.0 112.303 -176.111 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 2.6 m -79.14 147.16 6.94 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.671 0 C-N-CA 124.215 1.006 . . . . 0.0 110.084 167.326 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 68.6 p -127.53 148.05 50.33 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 124.52 1.128 . . . . 0.0 111.386 175.547 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -70.75 147.39 43.34 Favored Glycine 0 CA--C 1.534 1.26 0 C-N-CA 123.887 0.756 . . . . 0.0 114.001 -178.55 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 85.9 t -133.62 136.37 54.42 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 C-N-CA 125.362 1.465 . . . . 0.0 111.185 177.235 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 63.8 t80 -72.99 118.87 16.47 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 123.478 0.711 . . . . 0.0 112.78 -176.622 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 63.4 t0 -82.68 110.52 17.81 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 168.436 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 57.9 mt-10 -68.12 -25.86 65.51 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 124.692 1.197 . . . . 0.0 113.946 -175.445 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 38.0 tp10 -80.51 -48.44 12.78 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 123.255 0.622 . . . . 0.0 112.229 -176.371 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 99.1 p -78.82 -28.72 44.48 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 123.52 0.728 . . . . 0.0 112.473 173.416 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 82.15 31.13 32.34 Favored Glycine 0 CA--C 1.538 1.474 0 C-N-CA 124.853 1.216 . . . . 0.0 112.606 -177.049 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 56.2 mt-10 -135.34 145.59 47.57 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 118.636 1.218 . . . . 0.0 111.311 -173.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 69.9 m95 -77.54 141.02 39.82 Favored 'General case' 0 N--CA 1.466 0.342 0 O-C-N 121.273 -0.892 . . . . 0.0 111.523 177.235 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 17.3 m -135.91 142.59 38.6 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 C-N-CA 125.853 1.661 . . . . 0.0 112.757 -172.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 2.0 m0 -88.97 95.36 10.29 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 125.175 1.39 . . . . 0.0 108.019 170.168 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -69.5 160.94 30.51 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 124.291 1.036 . . . . 0.0 111.396 175.007 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 54.61 32.05 16.31 Favored 'General case' 0 CA--C 1.553 1.074 0 C-N-CA 125.04 1.336 . . . . 0.0 112.607 -177.92 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 73.0 m -125.15 146.73 49.36 Favored 'General case' 0 N--CA 1.479 0.984 0 O-C-N 120.978 -1.077 . . . . 0.0 113.564 -169.492 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 18.1 tt -143.19 149.29 18.55 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 C-N-CA 127.085 2.154 . . . . 0.0 110.85 177.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 72.6 tt0 -107.89 122.27 46.45 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 124.482 1.113 . . . . 0.0 110.002 168.744 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 2.0 t -144.16 142.11 24.29 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.866 0 C-N-CA 126.332 1.853 . . . . 0.0 109.682 -174.559 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 23.8 t-20 52.27 26.64 4.14 Favored 'General case' 0 CA--C 1.554 1.128 0 C-N-CA 125.526 1.531 . . . . 0.0 114.189 177.537 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 88.42 1.79 80.6 Favored Glycine 0 CA--C 1.54 1.646 0 C-N-CA 125.721 1.629 . . . . 0.0 116.455 -177.786 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 2.7 mptt -128.43 161.18 30.08 Favored 'General case' 0 N--CA 1.479 1.01 0 CA-C-N 119.42 1.61 . . . . 0.0 113.285 -177.823 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 3.6 m-85 -81.78 148.9 28.65 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 115.541 -0.754 . . . . 0.0 111.59 171.746 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 64.2 m-85 -152.87 161.79 42.11 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 126.334 1.853 . . . . 0.0 110.854 -178.106 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 596' ' ' HIS . . . . . . . . . . . . . 21.1 m80 -76.97 136.14 38.73 Favored 'General case' 0 N--CA 1.473 0.698 0 N-CA-C 108.259 -1.015 . . . . 0.0 108.259 167.222 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 47.8 p -59.39 -37.45 77.99 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 123.532 0.733 . . . . 0.0 112.375 178.114 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 5.7 p -70.31 -50.51 38.48 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.723 1.209 . . . . 0.0 112.637 175.171 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 599' ' ' CYS . . . . . . . . . . . . . 91.4 m -51.51 -52.26 48.34 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.278 1.031 . . . . 0.0 111.423 175.007 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 53.6 t80 -58.51 -52.21 66.61 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 123.483 0.713 . . . . 0.0 111.734 176.605 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 51.6 t-80 -61.81 -38.53 88.48 Favored 'General case' 0 N--CA 1.475 0.824 0 N-CA-C 113.372 0.878 . . . . 0.0 113.372 -176.489 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -71.07 -18.9 62.53 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 113.736 1.014 . . . . 0.0 113.736 175.567 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 88.7 m . . . . . 0 N--CA 1.476 0.83 0 C-N-CA 124.624 1.17 . . . . 0.0 112.132 -177.733 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 31.1 mm . . . . . 0 N--CA 1.473 0.687 0 N-CA-C 112.712 0.634 . . . . 0.0 112.712 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 9.4 ptp180 -70.08 -10.86 60.11 Favored 'General case' 0 N--CA 1.478 0.971 0 N-CA-C 115.756 1.761 . . . . 0.0 115.756 -170.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -77.42 -14.56 82.37 Favored Glycine 0 CA--C 1.539 1.542 0 C-N-CA 123.905 0.765 . . . . 0.0 114.838 178.04 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -71.59 147.05 47.99 Favored 'General case' 0 N--CA 1.477 0.911 0 CA-C-N 118.831 1.316 . . . . 0.0 113.472 -177.118 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 51.6 p90 -154.84 162.48 41.09 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 125.603 1.561 . . . . 0.0 111.698 169.554 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -134.74 137.57 50.79 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 C-N-CA 125.899 1.68 . . . . 0.0 110.295 177.709 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 40.7 t -68.29 132.02 33.06 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 C-N-CA 123.671 0.788 . . . . 0.0 109.951 -179.122 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 21.2 t -73.66 123.69 89.61 Favored Pre-proline 0 N--CA 1.474 0.745 0 C-N-CA 124.144 0.978 . . . . 0.0 109.131 171.075 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_endo -70.59 146.32 54.76 Favored 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 122.5 2.133 . . . . 0.0 111.699 178.045 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -62.98 -18.77 63.64 Favored 'General case' 0 N--CA 1.474 0.75 0 O-C-N 121.367 -0.833 . . . . 0.0 113.157 174.184 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 18.7 m -58.53 -32.76 69.16 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 124.943 1.297 . . . . 0.0 111.726 169.296 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 19.7 t -81.73 101.57 10.19 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.623 0.769 . . . . 0.0 111.372 172.079 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 93.0 mt-30 -71.86 -30.66 65.67 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 123.289 0.636 . . . . 0.0 112.242 175.071 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 76.5 m-20 -91.12 -19.7 22.83 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.152 0.981 . . . . 0.0 113.456 -177.348 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 6.2 mtt 55.76 33.08 20.72 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 125.815 1.646 . . . . 0.0 114.95 178.779 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -133.25 136.61 45.66 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.027 0.931 . . . . 0.0 113.24 -175.317 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -143.61 161.1 39.38 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 126.329 1.852 . . . . 0.0 110.753 175.53 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 23.7 tptt -94.75 157.85 15.77 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 124.442 1.097 . . . . 0.0 113.626 -173.957 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 15.2 t -109.98 96.45 25.08 Favored Pre-proline 0 CA--C 1.547 0.838 0 C-N-CA 126.755 2.022 . . . . 0.0 107.566 165.659 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -60.06 -17.61 46.1 Favored 'Trans proline' 0 CA--C 1.548 1.183 0 C-N-CA 122.586 2.191 . . . . 0.0 115.342 177.325 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 73.0 mt -72.58 -58.25 5.41 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.892 0 C-N-CA 124.81 1.244 . . . . 0.0 111.076 -179.942 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 13.7 p -101.93 1.64 37.04 Favored 'General case' 0 CA--C 1.553 1.074 0 N-CA-C 113.964 1.098 . . . . 0.0 113.964 -179.24 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 568' ' ' LYS . . . . . . . . . . . . . 53.6 mtmt 62.37 36.38 14.45 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 128.125 2.57 . . . . 0.0 113.322 -179.033 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 51.2 mm-40 -100.71 173.03 6.72 Favored 'General case' 0 N--CA 1.481 1.124 0 O-C-N 121.731 -0.606 . . . . 0.0 112.539 -177.796 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 59.2 m -118.26 120.97 39.25 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 124.542 1.137 . . . . 0.0 110.71 172.81 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 1.5 m -83.28 121.51 36.26 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.726 0 C-N-CA 124.837 1.255 . . . . 0.0 109.667 169.169 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 47.6 p -106.17 141.72 37.06 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 124.822 1.249 . . . . 0.0 111.263 175.002 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -65.91 148.27 50.88 Favored Glycine 0 CA--C 1.528 0.873 0 C-N-CA 124.099 0.857 . . . . 0.0 113.438 179.241 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 65.0 t -131.21 129.01 62.49 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 C-N-CA 125.743 1.617 . . . . 0.0 111.25 179.909 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 35.1 t80 -74.74 124.38 26.66 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 113.004 0.742 . . . . 0.0 113.004 -175.144 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 64.0 t0 -90.61 106.37 18.46 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.92 1.288 . . . . 0.0 109.156 168.609 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 57.7 mt-10 -66.54 -26.38 67.11 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.051 0.94 . . . . 0.0 113.427 -178.324 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -81.82 -44.72 16.55 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 124.38 1.072 . . . . 0.0 111.798 -178.642 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 53.9 m -77.37 -26.88 52.33 Favored 'General case' 0 N--CA 1.476 0.859 0 N-CA-C 112.946 0.721 . . . . 0.0 112.946 174.318 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 76.99 29.05 57.66 Favored Glycine 0 CA--C 1.539 1.561 0 C-N-CA 125.052 1.311 . . . . 0.0 113.52 -176.445 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 77.4 mm-40 -139.24 150.91 46.05 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 125.839 1.656 . . . . 0.0 111.164 -173.256 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 67.7 m95 -84.73 146.07 27.6 Favored 'General case' 0 N--CA 1.468 0.427 0 O-C-N 121.396 -0.815 . . . . 0.0 110.852 173.468 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 27.9 m -133.49 151.75 33.98 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.977 0 C-N-CA 125.838 1.655 . . . . 0.0 113.678 -178.382 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 3.3 m0 -105.22 107.89 19.12 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 127.241 2.217 . . . . 0.0 107.128 171.606 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -86.24 149.62 24.95 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 125.013 1.325 . . . . 0.0 112.594 -174.791 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 65.0 t30 50.8 32.57 7.31 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 126.106 1.762 . . . . 0.0 113.008 -169.576 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 98.0 m -113.81 146.57 39.76 Favored 'General case' 0 N--CA 1.476 0.833 0 O-C-N 120.92 -1.113 . . . . 0.0 111.993 -172.685 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 9.3 tt -127.55 137.52 57.44 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 C-N-CA 126.779 2.031 . . . . 0.0 110.783 175.101 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -94.98 130.86 41.46 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 125.302 1.441 . . . . 0.0 110.185 169.484 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 12.7 p -150.84 132.42 5.15 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 C-N-CA 124.813 1.245 . . . . 0.0 111.254 174.472 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 77.3 m-20 52.04 40.06 27.65 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 124.935 1.294 . . . . 0.0 114.484 174.504 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 77.4 10.24 86.36 Favored Glycine 0 CA--C 1.541 1.674 0 C-N-CA 125.39 1.472 . . . . 0.0 115.257 -178.866 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 48.6 mttp -133.2 171.65 13.73 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 126.885 2.074 . . . . 0.0 111.03 -170.837 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 84.6 m-85 -121.98 153.09 39.0 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 124.373 1.069 . . . . 0.0 113.673 -176.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 23.8 m-85 -151.87 164.82 36.29 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 126.986 2.115 . . . . 0.0 109.941 175.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 596' ' ' HIS . . . . . . . . . . . . . 25.5 m80 -77.76 138.67 39.14 Favored 'General case' 0 N--CA 1.468 0.46 0 N-CA-C 107.407 -1.331 . . . . 0.0 107.407 165.906 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 5.5 t -64.36 -39.07 93.14 Favored 'General case' 0 CA--C 1.539 0.539 0 O-C-N 121.597 -0.69 . . . . 0.0 111.952 -177.454 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 18.3 p -66.3 -37.28 85.05 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 124.735 1.214 . . . . 0.0 113.61 173.354 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 599' ' ' CYS . . . . . . . . . . . . . 72.3 m -63.88 -54.83 28.67 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 123.797 0.839 . . . . 0.0 110.644 173.337 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 75.9 t80 -57.97 -37.51 74.32 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 125.046 1.339 . . . . 0.0 112.665 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 11.8 t-160 -60.59 -35.52 76.3 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.231 1.012 . . . . 0.0 113.19 176.254 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -79.67 -33.35 41.28 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 113.65 0.982 . . . . 0.0 113.65 176.328 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 69.8 p . . . . . 0 N--CA 1.48 1.032 0 N-CA-C 114.645 1.35 . . . . 0.0 114.645 -174.922 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 14.6 mm . . . . . 0 N--CA 1.476 0.873 0 CA-C-O 120.632 0.253 . . . . 0.0 111.232 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 39.3 mmt180 -58.19 -25.5 61.64 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 124.24 1.016 . . . . 0.0 112.799 171.856 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -79.88 -7.62 88.36 Favored Glycine 0 CA--C 1.536 1.394 0 C-N-CA 125.966 1.746 . . . . 0.0 115.013 -179.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 8.9 mmpt? -66.7 147.02 53.83 Favored 'General case' 0 N--CA 1.482 1.131 0 CA-C-N 119.811 1.805 . . . . 0.0 111.091 171.793 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 52.5 p90 -151.51 162.46 40.92 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.549 0.739 . . . . 0.0 112.787 171.193 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 1.6 m -130.44 134.69 61.94 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.926 0 C-N-CA 125.853 1.661 . . . . 0.0 109.74 173.075 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 10.0 p -67.8 138.01 23.5 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 O-C-N 121.616 -0.678 . . . . 0.0 111.731 -175.75 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 57.6 t -87.94 112.09 46.87 Favored Pre-proline 0 CA--C 1.544 0.744 0 C-N-CA 125.459 1.504 . . . . 0.0 108.941 170.19 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 67.5 Cg_endo -76.66 156.33 35.67 Favored 'Trans proline' 0 C--N 1.348 0.525 0 C-N-CA 122.62 2.213 . . . . 0.0 111.664 176.045 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 46.7 tt0 -58.02 -33.49 69.01 Favored 'General case' 0 CA--C 1.54 0.59 0 O-C-N 121.331 -0.856 . . . . 0.0 112.282 174.125 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 15.2 m -59.04 -25.98 64.18 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 125.463 1.505 . . . . 0.0 113.719 175.299 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 10.0 t -69.12 -23.61 64.0 Favored 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 113.092 0.775 . . . . 0.0 113.092 177.229 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 30.5 mt-30 59.35 -62.37 0.05 OUTLIER 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 129.211 3.005 . . . . 0.0 115.915 176.251 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 65.9 m-20 -82.21 -14.14 56.03 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 125.733 1.613 . . . . 0.0 113.374 -175.804 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 11.1 mtt 56.96 25.68 10.91 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 126.398 1.879 . . . . 0.0 114.976 179.582 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -131.42 144.75 51.42 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.265 1.026 . . . . 0.0 113.265 -171.748 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 4.5 t80 -153.84 -178.45 7.06 Favored 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 125.899 1.68 . . . . 0.0 109.668 173.131 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 5.2 tmmm? -137.05 134.17 36.25 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 125.027 1.331 . . . . 0.0 112.635 -178.695 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 30.9 t -69.55 117.17 50.4 Favored Pre-proline 0 CA--C 1.543 0.707 0 C-N-CA 126.681 1.993 . . . . 0.0 111.007 174.086 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_exo -65.11 -26.59 57.56 Favored 'Trans proline' 0 CA--C 1.542 0.885 0 C-N-CA 123.047 2.498 . . . . 0.0 114.646 175.739 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 80.6 mt -71.52 -57.46 7.44 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 C-N-CA 124.622 1.169 . . . . 0.0 111.418 -173.325 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 16.9 p -98.54 -1.86 40.1 Favored 'General case' 0 CA--C 1.549 0.932 0 N-CA-C 113.61 0.967 . . . . 0.0 113.61 179.276 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 568' ' ' LYS . . . . . . . . . . . . . 95.7 mttt 60.35 46.7 9.73 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 126.621 1.968 . . . . 0.0 112.778 -177.781 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 73.2 mm-40 -125.85 139.08 53.78 Favored 'General case' 0 N--CA 1.483 1.176 0 N-CA-C 115.481 1.66 . . . . 0.0 115.481 -174.24 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 24.4 m -69.66 138.51 53.07 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.734 1.214 . . . . 0.0 113.127 -179.109 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -112.73 140.07 34.5 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 C-N-CA 126.639 1.976 . . . . 0.0 109.904 167.841 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 44.4 p -130.42 144.03 51.14 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 125.377 1.471 . . . . 0.0 110.961 178.452 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -65.95 144.27 46.3 Favored Glycine 0 CA--C 1.53 1.006 0 C-N-CA 123.773 0.701 . . . . 0.0 114.093 -179.118 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 19.2 m -128.92 149.22 33.43 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 C-N-CA 125.68 1.592 . . . . 0.0 111.742 174.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 62.8 t80 -74.25 140.42 44.99 Favored 'General case' 0 CA--C 1.542 0.663 0 O-C-N 121.311 -0.868 . . . . 0.0 113.08 -175.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 21.1 t0 -115.81 118.53 33.28 Favored 'General case' 0 C--O 1.236 0.342 0 C-N-CA 126.776 2.031 . . . . 0.0 110.82 171.186 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 23.6 mp0 -74.27 -25.97 59.92 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 124.183 0.993 . . . . 0.0 113.383 -177.389 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 37.2 tp10 -74.48 -49.13 23.44 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 124.421 1.088 . . . . 0.0 112.195 -179.459 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 20.5 m -77.18 -31.71 55.6 Favored 'General case' 0 N--CA 1.476 0.833 0 O-C-N 121.739 -0.601 . . . . 0.0 111.924 172.637 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 76.38 30.48 56.7 Favored Glycine 0 CA--C 1.535 1.309 0 C-N-CA 123.506 0.574 . . . . 0.0 111.878 -170.11 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 79.9 mm-40 -130.95 175.92 8.67 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 126.253 1.821 . . . . 0.0 111.085 -174.166 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 62.4 m95 -100.15 149.77 23.19 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 123.969 0.908 . . . . 0.0 111.026 172.306 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 13.0 m -140.84 147.05 23.14 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 C-N-CA 125.94 1.696 . . . . 0.0 112.871 -172.311 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 4.1 m0 -97.64 106.64 18.99 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 125.905 1.682 . . . . 0.0 107.891 169.057 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 42.8 mtmt -81.96 153.22 26.37 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 124.133 0.973 . . . . 0.0 112.282 -179.456 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 54.25 33.65 18.66 Favored 'General case' 0 CA--C 1.554 1.101 0 C-N-CA 125.646 1.578 . . . . 0.0 111.601 -174.825 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 65.5 m -130.03 150.86 51.12 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 125.307 1.443 . . . . 0.0 112.293 -169.407 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 9.9 tt -140.24 146.32 24.82 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.653 0 C-N-CA 128.508 2.723 . . . . 0.0 110.108 -179.667 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 67.3 tt0 -113.77 132.87 55.69 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 125.35 1.46 . . . . 0.0 110.689 170.272 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 9.4 p -157.19 143.71 9.71 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 C-N-CA 124.479 1.112 . . . . 0.0 111.411 176.378 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 9.4 t-20 52.78 32.9 13.0 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 125.285 1.434 . . . . 0.0 114.421 178.223 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 76.05 9.76 85.33 Favored Glycine 0 CA--C 1.538 1.489 0 C-N-CA 124.698 1.142 . . . . 0.0 115.563 -177.511 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 99.6 mttt -122.13 152.45 39.88 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 126.013 1.725 . . . . 0.0 111.493 -179.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 79.0 m-85 -98.65 150.62 21.57 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 124.084 0.954 . . . . 0.0 112.751 170.304 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 93.4 m-85 -151.44 161.51 42.56 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 125.959 1.704 . . . . 0.0 110.1 -179.681 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 596' ' ' HIS . . . . . . . . . . . . . 28.6 m80 -75.71 141.89 42.58 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 167.027 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 50.3 p -61.26 -42.71 99.1 Favored 'General case' 0 N--CA 1.47 0.525 0 C-N-CA 123.592 0.757 . . . . 0.0 112.214 -179.321 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 2.7 p -68.35 -42.0 79.85 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 124.42 1.088 . . . . 0.0 112.791 175.457 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 599' ' ' CYS . . . . . . . . . . . . . 69.4 m -58.68 -59.2 5.79 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.192 0.997 . . . . 0.0 110.894 175.068 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 79.2 t80 -57.76 -43.25 85.35 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.375 1.07 . . . . 0.0 112.648 -177.912 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 82.5 t60 -58.13 -39.49 78.85 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 179.855 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 37.9 tp10 -90.45 -25.26 20.43 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 114.241 1.2 . . . . 0.0 114.241 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 28.3 m . . . . . 0 N--CA 1.482 1.164 0 N-CA-C 115.766 1.765 . . . . 0.0 115.766 -166.924 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 22.7 mm . . . . . 0 N--CA 1.476 0.829 0 CA-C-O 120.509 0.195 . . . . 0.0 111.45 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 30.7 mmm-85 -64.59 -29.93 70.95 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.739 1.216 . . . . 0.0 112.693 178.564 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -82.54 -7.29 87.7 Favored Glycine 0 CA--C 1.535 1.282 0 C-N-CA 125.056 1.312 . . . . 0.0 115.133 179.9 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -69.99 145.85 51.51 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 118.904 1.352 . . . . 0.0 111.829 176.806 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 38.6 p90 -153.39 166.92 31.15 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 125.032 1.333 . . . . 0.0 112.773 175.296 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 2.4 m -131.1 138.72 52.75 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.5 0 C-N-CA 125.733 1.613 . . . . 0.0 110.136 169.774 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 9.9 p -69.36 136.41 26.32 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 O-C-N 121.319 -0.863 . . . . 0.0 111.623 -176.993 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 51.1 t -76.31 123.89 88.0 Favored Pre-proline 0 CA--C 1.543 0.706 0 C-N-CA 124.805 1.242 . . . . 0.0 109.586 177.352 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -74.9 150.2 38.33 Favored 'Trans proline' 0 CA--C 1.543 0.939 0 C-N-CA 122.993 2.462 . . . . 0.0 111.028 175.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 50.3 mt-10 -65.09 -19.29 65.92 Favored 'General case' 0 CA--C 1.549 0.926 0 N-CA-C 113.479 0.918 . . . . 0.0 113.479 177.723 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 68.2 p -68.71 -24.92 64.54 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 124.216 1.006 . . . . 0.0 113.153 170.334 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 17.5 t -79.36 76.55 5.93 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-O 122.371 1.081 . . . . 0.0 110.299 169.791 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 62.6 tt0 -60.33 -34.45 73.84 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.356 1.062 . . . . 0.0 112.956 -174.496 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 69.4 m-20 -87.51 -6.59 58.3 Favored 'General case' 0 CA--C 1.551 0.981 0 C-N-CA 124.954 1.302 . . . . 0.0 113.74 175.114 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 9.0 mtt 52.24 38.44 24.66 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 126.785 2.034 . . . . 0.0 114.188 -178.116 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -128.26 143.43 51.03 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 114.244 1.201 . . . . 0.0 114.244 -173.168 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -143.36 176.54 9.08 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 126.487 1.915 . . . . 0.0 109.322 172.826 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 563' ' ' LYS . . . . . . . . . . . . 0.255 0.0 OUTLIER -141.76 148.16 38.52 Favored 'General case' 0 N--CA 1.477 0.888 0 N-CA-C 114.767 1.395 . . . . 0.0 114.767 175.891 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 12.0 t -79.32 116.85 63.49 Favored Pre-proline 0 CA--C 1.542 0.636 0 C-N-CA 126.765 2.026 . . . . 0.0 111.006 173.451 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_endo -72.51 -18.15 26.12 Favored 'Trans proline' 0 CA--C 1.545 1.073 0 C-N-CA 122.719 2.279 . . . . 0.0 113.612 174.782 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 90.7 mt -71.49 -55.22 14.47 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.9 0 C-N-CA 124.514 1.125 . . . . 0.0 110.747 -178.442 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 13.9 p -103.61 2.52 33.42 Favored 'General case' 0 CA--C 1.552 1.028 0 N-CA-C 114.137 1.162 . . . . 0.0 114.137 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 568' ' ' LYS . . . . . . . . . . . . 0.308 11.9 ptmm? 54.52 46.61 24.52 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 127.04 2.136 . . . . 0.0 113.82 -177.045 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 69.2 mm-40 -124.81 143.33 50.87 Favored 'General case' 0 N--CA 1.482 1.143 0 N-CA-C 114.835 1.42 . . . . 0.0 114.835 -176.108 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 73.9 m -78.06 145.66 35.72 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 124.241 1.017 . . . . 0.0 112.749 -178.589 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -119.61 131.7 71.43 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.892 0 C-N-CA 127.014 2.126 . . . . 0.0 109.752 168.305 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 38.9 p -111.86 147.02 36.67 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 125.064 1.345 . . . . 0.0 111.753 178.277 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -71.02 147.57 43.16 Favored Glycine 0 CA--C 1.532 1.101 0 C-N-CA 124.933 1.254 . . . . 0.0 113.743 178.621 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 60.9 t -139.47 132.49 36.93 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 C-N-CA 124.56 1.144 . . . . 0.0 111.083 -176.465 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 68.5 t80 -70.12 112.1 6.24 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 118.706 0.684 . . . . 0.0 111.522 179.478 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 23.2 t0 -81.8 112.02 18.57 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 123.331 0.653 . . . . 0.0 109.559 169.39 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 53.6 mt-10 -69.43 -19.31 63.79 Favored 'General case' 0 CA--C 1.546 0.812 0 N-CA-C 113.913 1.079 . . . . 0.0 113.913 178.836 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 33.2 tp10 -77.38 -51.41 10.86 Favored 'General case' 0 CA--C 1.543 0.71 0 O-C-N 121.366 -0.834 . . . . 0.0 112.811 178.898 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 32.2 t -76.06 -33.42 59.58 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 124.309 1.044 . . . . 0.0 112.686 172.318 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 86.09 31.18 20.84 Favored Glycine 0 CA--C 1.531 1.064 0 C-N-CA 125.038 1.304 . . . . 0.0 113.63 -176.761 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 74.1 mm-40 -142.31 151.66 42.19 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 125.504 1.522 . . . . 0.0 111.825 -172.459 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 82.5 m95 -75.84 134.4 40.36 Favored 'General case' 0 N--CA 1.468 0.437 0 O-C-N 121.653 -0.654 . . . . 0.0 111.7 172.521 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 17.0 m -135.05 143.0 38.5 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.559 0 C-N-CA 125.414 1.486 . . . . 0.0 113.327 -171.844 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 3.7 m0 -91.03 100.95 13.72 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 126.287 1.835 . . . . 0.0 107.857 169.288 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -73.98 153.85 39.56 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 124.169 0.988 . . . . 0.0 111.66 -179.68 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 54.63 36.75 26.76 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 125.03 1.332 . . . . 0.0 112.047 179.409 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 85.0 m -129.83 148.19 51.68 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 125.173 1.389 . . . . 0.0 112.113 -170.328 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 15.4 tt -145.84 146.3 19.46 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 C-N-CA 126.912 2.085 . . . . 0.0 111.503 -178.388 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 8.9 tm-20 -107.54 145.6 32.94 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.852 1.261 . . . . 0.0 111.172 166.343 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 1.2 t -159.32 144.58 6.56 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 C-N-CA 126.196 1.798 . . . . 0.0 109.765 171.589 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 10.6 t-20 54.99 29.87 13.09 Favored 'General case' 0 CA--C 1.554 1.133 0 N-CA-C 114.17 1.174 . . . . 0.0 114.17 175.036 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 76.73 14.06 82.91 Favored Glycine 0 CA--C 1.535 1.284 0 C-N-CA 124.618 1.104 . . . . 0.0 115.066 -176.45 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 51.1 mttp -131.31 146.83 52.46 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 126.088 1.755 . . . . 0.0 110.873 -171.337 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 57.4 m-85 -102.35 147.85 26.2 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 123.857 0.863 . . . . 0.0 112.838 -178.329 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 89.8 m-85 -153.19 164.46 38.02 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.914 1.686 . . . . 0.0 111.574 -169.879 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 596' ' ' HIS . . . . . . . . . . . . . 17.6 m80 -77.83 140.72 39.4 Favored 'General case' 0 N--CA 1.473 0.694 0 O-C-N 121.023 -1.048 . . . . 0.0 108.706 166.204 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 78.3 p -58.4 -42.24 86.69 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 123.657 0.783 . . . . 0.0 112.234 178.304 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 22.8 p -67.92 -47.71 67.99 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 125.533 1.533 . . . . 0.0 113.213 174.854 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 599' ' ' CYS . . . . . . . . . . . . . 86.4 m -60.65 -50.63 72.75 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 123.436 0.694 . . . . 0.0 111.493 179.732 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 88.2 t80 -56.07 -45.22 79.39 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 123.291 0.637 . . . . 0.0 112.135 178.227 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 22.7 t-160 -63.67 -46.56 84.99 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 112.939 0.718 . . . . 0.0 112.939 177.736 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 14.9 tm-20 -70.42 -33.4 71.3 Favored 'General case' 0 CA--C 1.543 0.702 0 O-C-N 121.502 -0.749 . . . . 0.0 112.649 -179.642 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 96.0 m . . . . . 0 N--CA 1.475 0.818 0 C-N-CA 124.619 1.168 . . . . 0.0 112.06 177.823 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 14.1 mm . . . . . 0 N--CA 1.476 0.849 0 N-CA-C 112.451 0.537 . . . . 0.0 112.451 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 32.8 ttm180 -61.33 -21.48 64.04 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 125.158 1.383 . . . . 0.0 113.924 178.051 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -71.85 -12.74 75.04 Favored Glycine 0 CA--C 1.539 1.566 0 N-CA-C 115.289 0.876 . . . . 0.0 115.289 177.271 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -70.96 147.91 48.22 Favored 'General case' 0 N--CA 1.478 0.944 0 CA-C-N 118.965 1.383 . . . . 0.0 112.129 177.844 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 46.8 p90 -152.59 165.81 34.01 Favored 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 114.008 1.114 . . . . 0.0 114.008 176.127 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 1.1 m -135.67 139.5 46.22 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.035 0 C-N-CA 126.757 2.023 . . . . 0.0 110.484 174.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 55.5 t -69.71 133.09 32.46 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.298 0 O-C-N 120.889 -1.132 . . . . 0.0 111.662 -176.021 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 95.0 t -69.37 124.17 89.91 Favored Pre-proline 0 N--CA 1.476 0.837 0 C-N-CA 124.725 1.21 . . . . 0.0 109.035 170.263 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 93.7 Cg_endo -78.35 143.48 19.68 Favored 'Trans proline' 0 CA--C 1.536 0.596 0 C-N-CA 123.152 2.568 . . . . 0.0 111.977 174.477 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -61.55 -24.76 66.86 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.08 0.952 . . . . 0.0 113.248 -179.559 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 58.6 p -72.18 -26.45 62.07 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 124.7 1.2 . . . . 0.0 113.523 177.207 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 39.7 m -80.85 88.94 5.82 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-N 119.336 0.971 . . . . 0.0 110.829 175.01 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 83.4 mt-30 -56.1 -30.97 62.82 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.205 1.402 . . . . 0.0 113.984 -176.694 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 69.4 m-20 -76.87 -21.73 54.51 Favored 'General case' 0 CA--C 1.545 0.784 0 N-CA-C 113.859 1.059 . . . . 0.0 113.859 178.257 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 66.8 mtp 51.3 32.67 8.62 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 126.105 1.762 . . . . 0.0 113.27 -173.488 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -147.97 154.12 39.91 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 124.691 1.196 . . . . 0.0 113.035 -170.346 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 6.9 t80 -153.94 155.64 36.0 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 124.922 1.289 . . . . 0.0 110.502 173.164 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 3.2 tmmm? -106.58 115.4 30.14 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 125.171 1.388 . . . . 0.0 111.985 -173.695 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 35.5 t -54.37 111.38 2.84 Favored Pre-proline 0 CA--C 1.545 0.768 0 C-N-CA 127.596 2.358 . . . . 0.0 111.279 174.876 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -62.74 -21.52 73.08 Favored 'Trans proline' 0 CA--C 1.539 0.755 0 C-N-CA 123.018 2.478 . . . . 0.0 114.957 178.894 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 96.7 mt -74.54 -57.56 6.34 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 C-N-CA 123.965 0.906 . . . . 0.0 111.164 -176.653 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 16.7 p -102.48 -0.94 31.54 Favored 'General case' 0 CA--C 1.551 0.986 0 N-CA-C 113.784 1.031 . . . . 0.0 113.784 -176.76 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 568' ' ' LYS . . . . . . . . . . . . . 32.9 mmtp 61.27 46.4 7.9 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 127.201 2.2 . . . . 0.0 112.985 -176.795 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 75.7 mt-10 -122.3 136.02 54.83 Favored 'General case' 0 N--CA 1.487 1.405 0 N-CA-C 114.737 1.384 . . . . 0.0 114.737 -173.916 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 79.2 m -83.49 116.85 22.73 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 112.896 0.702 . . . . 0.0 112.896 -179.016 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -85.27 147.56 5.43 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 C-N-CA 124.74 1.216 . . . . 0.0 110.116 167.068 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 58.4 p -133.32 151.37 51.87 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 125.636 1.574 . . . . 0.0 111.25 -179.37 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -70.15 158.53 53.5 Favored Glycine 0 CA--C 1.535 1.327 0 N-CA-C 114.965 0.746 . . . . 0.0 114.965 -176.034 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 9.2 p -140.52 143.37 29.26 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 125.099 1.36 . . . . 0.0 111.763 170.128 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 9.2 t80 -75.07 127.13 32.51 Favored 'General case' 0 CA--C 1.549 0.932 0 N-CA-C 113.905 1.076 . . . . 0.0 113.905 -173.922 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 37.7 t0 -97.85 101.19 12.63 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 125.812 1.645 . . . . 0.0 109.494 168.638 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -63.89 -26.61 68.68 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 124.651 1.181 . . . . 0.0 113.454 -179.194 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 73.2 mm-40 -78.03 -46.06 21.97 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 123.664 0.786 . . . . 0.0 112.468 -178.152 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 71.2 m -77.62 -29.36 51.76 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 123.446 0.698 . . . . 0.0 112.33 173.212 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 81.46 26.82 50.12 Favored Glycine 0 CA--C 1.534 1.257 0 C-N-CA 123.957 0.789 . . . . 0.0 112.963 -175.375 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 79.6 mm-40 -137.68 161.18 37.17 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 126.345 1.858 . . . . 0.0 110.148 -173.034 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 32.6 m95 -96.35 150.26 20.77 Favored 'General case' 0 CA--C 1.54 0.59 0 O-C-N 120.941 -1.1 . . . . 0.0 111.569 175.795 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 9.9 m -135.6 144.9 32.54 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 C-N-CA 125.299 1.44 . . . . 0.0 113.115 -173.686 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 3.2 m0 -92.0 104.86 17.22 Favored 'General case' 0 C--O 1.234 0.276 0 C-N-CA 126.67 1.988 . . . . 0.0 109.411 170.035 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -73.76 152.53 40.32 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 124.679 1.192 . . . . 0.0 112.104 178.421 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 54.73 29.86 12.49 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 125.519 1.527 . . . . 0.0 112.433 -177.662 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 62.0 m -125.05 149.22 48.01 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 124.517 1.127 . . . . 0.0 112.797 -169.303 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 14.9 tt -136.14 145.48 30.83 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.585 0 C-N-CA 127.906 2.482 . . . . 0.0 110.373 177.516 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 71.3 tt0 -107.77 123.48 48.61 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.659 1.184 . . . . 0.0 109.618 169.723 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 7.6 p -157.56 146.27 10.12 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 C-N-CA 124.774 1.23 . . . . 0.0 110.518 -177.028 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 8.2 t-20 52.88 35.19 18.36 Favored 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 124.642 1.177 . . . . 0.0 112.894 -175.649 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 68.67 14.39 67.29 Favored Glycine 0 CA--C 1.536 1.35 0 C-N-CA 125.5 1.524 . . . . 0.0 115.661 -178.291 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 35.9 mtmm -133.31 156.89 46.77 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 125.937 1.695 . . . . 0.0 111.456 -175.671 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 85.8 m-85 -90.74 147.26 23.36 Favored 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 113.001 0.741 . . . . 0.0 113.001 172.588 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 78.4 m-85 -150.44 160.72 43.56 Favored 'General case' 0 C--N 1.329 -0.326 0 C-N-CA 126.235 1.814 . . . . 0.0 110.043 -175.612 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 596' ' ' HIS . . . . . . . . . . . . . 26.0 m80 -75.2 139.08 42.4 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 108.486 -0.931 . . . . 0.0 108.486 167.136 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 59.2 p -59.91 -40.16 87.86 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.634 0.774 . . . . 0.0 111.812 177.653 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 9.4 p -71.25 -36.83 71.92 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 125.693 1.597 . . . . 0.0 113.113 176.72 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 599' ' ' CYS . . . . . . . . . . . . . 69.2 m -64.75 -59.48 4.18 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.353 1.061 . . . . 0.0 111.186 174.795 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 61.7 t80 -53.3 -41.51 65.7 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.363 1.065 . . . . 0.0 113.069 -177.179 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 83.2 t60 -61.4 -34.2 74.95 Favored 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 114.879 1.437 . . . . 0.0 114.879 -177.476 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 35.1 tp10 -102.22 -18.75 15.36 Favored 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 114.196 1.184 . . . . 0.0 114.196 -176.277 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 50.1 m . . . . . 0 N--CA 1.481 1.09 0 N-CA-C 115.993 1.849 . . . . 0.0 115.993 -167.977 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 30.0 mm . . . . . 0 CA--C 1.54 0.582 0 CA-C-O 120.824 0.345 . . . . 0.0 110.891 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 71.4 mtp180 -85.68 -20.8 28.84 Favored 'General case' 0 N--CA 1.481 1.1 0 N-CA-C 113.389 0.885 . . . . 0.0 113.389 -175.279 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -72.63 -10.97 76.92 Favored Glycine 0 CA--C 1.54 1.626 0 C-N-CA 125.467 1.508 . . . . 0.0 114.466 171.686 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 70.1 mmtt -66.34 140.12 58.07 Favored 'General case' 0 N--CA 1.477 0.918 0 CA-C-N 119.089 1.444 . . . . 0.0 111.747 173.271 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 46.1 p90 -153.79 164.86 37.64 Favored 'General case' 0 C--O 1.238 0.467 0 C-N-CA 124.253 1.021 . . . . 0.0 111.723 169.613 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -134.37 135.33 54.21 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 C-N-CA 125.563 1.545 . . . . 0.0 109.736 175.045 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 53.9 t -67.95 133.07 32.21 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.104 0 C-N-CA 123.741 0.816 . . . . 0.0 110.731 -177.349 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 5.3 t -84.92 116.17 64.21 Favored Pre-proline 0 CA--C 1.541 0.61 0 C-N-CA 124.117 0.967 . . . . 0.0 109.84 173.805 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -76.69 163.33 31.76 Favored 'Trans proline' 0 CA--C 1.536 0.623 0 C-N-CA 122.509 2.139 . . . . 0.0 112.162 176.887 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 39.8 mm-40 -62.38 -28.64 69.91 Favored 'General case' 0 CA--C 1.548 0.895 0 O-C-N 121.296 -0.878 . . . . 0.0 112.562 173.04 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 69.7 p -67.59 -18.0 64.84 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 125.038 1.335 . . . . 0.0 113.322 175.793 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 18.2 m -80.81 -0.6 39.46 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 114.335 1.235 . . . . 0.0 114.335 169.684 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 88.4 mt-30 45.36 -84.43 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 128.571 2.748 . . . . 0.0 116.621 169.268 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 71.1 m-20 -70.83 -9.35 57.35 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 125.446 1.498 . . . . 0.0 113.914 178.738 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 12.1 mtt 57.99 31.14 20.23 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 126.002 1.721 . . . . 0.0 115.043 178.024 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -122.56 141.84 51.25 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 124.024 0.93 . . . . 0.0 112.943 -177.401 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -149.59 157.84 43.62 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 124.979 1.312 . . . . 0.0 111.436 179.703 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 39.2 ttpt -104.11 144.95 30.88 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 124.795 1.238 . . . . 0.0 114.197 -170.553 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 12.2 t -100.63 107.21 47.64 Favored Pre-proline 0 CA--C 1.541 0.632 0 C-N-CA 126.833 2.053 . . . . 0.0 108.607 166.943 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo -69.96 -16.96 36.91 Favored 'Trans proline' 0 CA--C 1.546 1.097 0 C-N-CA 122.502 2.134 . . . . 0.0 113.443 177.53 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 87.6 mt -72.9 -57.78 6.3 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 C-N-CA 124.12 0.968 . . . . 0.0 111.13 -178.957 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 15.5 p -98.11 -1.93 41.22 Favored 'General case' 0 CA--C 1.552 1.022 0 N-CA-C 113.648 0.981 . . . . 0.0 113.648 179.697 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 568' ' ' LYS . . . . . . . . . . . . . 45.6 tttt 59.73 45.84 12.37 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 126.522 1.929 . . . . 0.0 112.705 -177.736 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 70.3 mm-40 -117.59 166.09 12.79 Favored 'General case' 0 N--CA 1.482 1.149 0 N-CA-C 112.83 0.678 . . . . 0.0 112.83 -178.688 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 89.7 m -112.2 118.53 35.57 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.972 0.909 . . . . 0.0 111.199 179.34 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 3.5 m -79.53 138.58 19.71 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 123.486 0.715 . . . . 0.0 110.26 167.721 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 41.4 p -120.99 142.56 49.67 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 124.818 1.247 . . . . 0.0 110.077 176.307 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -65.92 144.15 46.15 Favored Glycine 0 CA--C 1.533 1.18 0 O-C-N 122.067 -0.395 . . . . 0.0 112.804 178.788 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 86.4 t -129.24 131.95 67.25 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 C-N-CA 125.237 1.415 . . . . 0.0 110.938 -178.901 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 71.5 t80 -71.82 117.49 13.48 Favored 'General case' 0 CA--C 1.549 0.912 0 CA-C-N 118.622 0.647 . . . . 0.0 112.315 -178.395 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 39.7 t0 -84.45 111.01 19.09 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.534 1.134 . . . . 0.0 109.469 169.016 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 54.5 mt-10 -68.9 -24.16 64.28 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 113.672 0.99 . . . . 0.0 113.672 -179.22 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 61.0 mt-10 -77.32 -42.0 38.43 Favored 'General case' 0 N--CA 1.475 0.788 0 O-C-N 121.207 -0.933 . . . . 0.0 112.908 -176.166 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 96.8 p -91.34 -24.74 19.7 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.852 0.861 . . . . 0.0 113.092 172.366 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 82.05 32.16 29.94 Favored Glycine 0 CA--C 1.533 1.159 0 C-N-CA 124.228 0.918 . . . . 0.0 113.124 -178.61 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 61.4 mm-40 -134.49 149.55 50.71 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 125.189 1.396 . . . . 0.0 111.439 -173.881 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 78.4 m95 -79.62 141.7 36.28 Favored 'General case' 0 CA--C 1.535 0.402 0 O-C-N 121.22 -0.925 . . . . 0.0 111.257 171.668 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 21.1 m -137.01 143.85 33.74 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 C-N-CA 125.703 1.601 . . . . 0.0 113.124 -174.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 2.2 m0 -95.64 102.27 14.05 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 126.561 1.944 . . . . 0.0 107.739 170.37 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -79.32 148.75 31.98 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.873 1.269 . . . . 0.0 112.224 -176.873 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 61.0 t30 52.41 36.27 19.56 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.759 1.624 . . . . 0.0 112.805 -173.174 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 86.4 m -119.55 147.67 44.19 Favored 'General case' 0 N--CA 1.479 0.982 0 O-C-N 120.739 -1.226 . . . . 0.0 112.064 -172.589 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 8.9 tt -145.16 145.49 20.71 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.586 0 C-N-CA 127.312 2.245 . . . . 0.0 110.78 -177.123 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 63.0 tt0 -113.39 128.83 56.59 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.867 1.267 . . . . 0.0 109.417 168.009 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 7.5 p -152.52 135.9 7.8 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.832 0 C-N-CA 125.35 1.46 . . . . 0.0 110.636 -178.058 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 72.4 m-20 53.99 34.01 18.75 Favored 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 124.868 1.267 . . . . 0.0 113.756 -176.129 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 78.02 11.87 84.95 Favored Glycine 0 CA--C 1.537 1.465 0 C-N-CA 124.985 1.279 . . . . 0.0 115.484 -179.899 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -129.86 150.76 51.01 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 125.311 1.444 . . . . 0.0 111.559 -178.528 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 14.2 m-85 -93.48 147.21 23.18 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.611 1.165 . . . . 0.0 112.238 177.749 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 95.3 m-85 -154.08 165.08 37.31 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 126.027 1.731 . . . . 0.0 111.176 -177.248 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 596' ' ' HIS . . . . . . . . . . . . . 21.5 m80 -79.32 142.45 36.08 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 108.142 -1.058 . . . . 0.0 108.142 165.424 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 7.8 t -66.56 -39.06 88.33 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 118.997 0.817 . . . . 0.0 112.012 -178.144 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 21.7 p -63.4 -44.53 94.38 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.109 0.963 . . . . 0.0 112.974 171.781 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 599' ' ' CYS . . . . . . . . . . . . . 93.1 m -62.32 -50.96 69.56 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.042 0.937 . . . . 0.0 111.044 177.367 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 56.9 t80 -57.37 -43.75 83.84 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 123.778 0.831 . . . . 0.0 111.889 176.517 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 84.4 t60 -62.55 -40.76 97.86 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 123.64 0.776 . . . . 0.0 112.718 178.454 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 73.3 mm-40 -69.28 -36.86 77.52 Favored 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 113.46 0.911 . . . . 0.0 113.46 173.496 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 71.4 m . . . . . 0 N--CA 1.477 0.915 0 C-N-CA 124.077 0.951 . . . . 0.0 112.369 -176.883 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 23.3 mm . . . . . 0 N--CA 1.474 0.756 0 CA-C-O 120.255 0.074 . . . . 0.0 111.173 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 21.2 mmt85 -65.54 -36.65 84.42 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 124.526 1.131 . . . . 0.0 112.321 176.682 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -68.4 -14.27 66.47 Favored Glycine 0 CA--C 1.528 0.901 0 C-N-CA 126.215 1.864 . . . . 0.0 114.278 -179.886 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 65.7 mmtt -76.6 95.26 3.9 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 118.731 1.265 . . . . 0.0 108.659 168.799 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 30.9 p90 -105.91 162.0 13.96 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 113.736 -1.575 . . . . 0.0 111.814 170.353 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 4.3 m -127.85 142.25 44.21 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.617 0 C-N-CA 125.912 1.685 . . . . 0.0 109.803 172.042 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 94.5 t -69.19 135.32 28.59 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 O-C-N 121.606 -0.684 . . . . 0.0 110.742 -176.656 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 97.5 t -68.98 119.73 71.67 Favored Pre-proline 0 CA--C 1.545 0.752 0 C-N-CA 124.04 0.936 . . . . 0.0 108.985 173.283 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo -76.21 154.67 37.07 Favored 'Trans proline' 0 CA--C 1.535 0.568 0 C-N-CA 123.189 2.593 . . . . 0.0 112.472 -177.556 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 17.3 pt-20 -65.3 -17.29 64.39 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 113.199 0.814 . . . . 0.0 113.199 173.779 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 77.4 p -73.09 -22.39 60.58 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.113 0.965 . . . . 0.0 113.005 173.807 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 30.5 t -79.2 110.38 14.41 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 119.281 0.946 . . . . 0.0 110.889 173.578 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 26.5 mp0 -71.95 -31.11 66.0 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.208 1.003 . . . . 0.0 112.53 -178.635 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 66.6 m-20 -108.71 -2.8 18.36 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 125.508 1.523 . . . . 0.0 113.998 -174.793 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 7.4 mtt 55.22 37.53 29.04 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.524 1.53 . . . . 0.0 112.889 -171.718 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -133.02 142.19 48.68 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.312 1.045 . . . . 0.0 113.292 -173.338 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 28.0 t80 -152.63 159.76 43.2 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 125.799 1.64 . . . . 0.0 109.789 174.09 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 38.8 ttmt -118.16 134.71 54.75 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 124.583 1.153 . . . . 0.0 113.737 -170.429 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 19.6 t -73.03 116.78 53.96 Favored Pre-proline 0 CA--C 1.541 0.617 0 C-N-CA 126.104 1.762 . . . . 0.0 110.509 169.308 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 93.2 Cg_endo -71.77 -18.04 28.8 Favored 'Trans proline' 0 CA--C 1.543 0.951 0 C-N-CA 122.892 2.394 . . . . 0.0 113.974 173.315 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 73.6 mt -72.04 -56.67 9.37 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 C-N-CA 123.948 0.899 . . . . 0.0 110.413 -177.456 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 15.6 p -100.99 -0.67 36.11 Favored 'General case' 0 CA--C 1.552 1.055 0 N-CA-C 113.911 1.078 . . . . 0.0 113.911 178.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 568' ' ' LYS . . . . . . . . . . . . . 33.6 tttt 63.73 39.61 8.42 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 126.644 1.978 . . . . 0.0 113.824 -179.041 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 78.6 mm-40 -123.59 138.49 54.54 Favored 'General case' 0 N--CA 1.481 1.099 0 N-CA-C 114.136 1.161 . . . . 0.0 114.136 -171.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 80.5 m -83.64 122.48 28.66 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 124.589 1.155 . . . . 0.0 112.42 -179.28 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 1.7 t -79.33 141.49 15.29 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 C-N-CA 124.715 1.206 . . . . 0.0 109.223 168.106 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 43.1 p -113.66 138.72 49.81 Favored 'General case' 0 N--CA 1.475 0.825 0 C-N-CA 124.67 1.188 . . . . 0.0 109.997 169.28 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -65.97 150.8 51.94 Favored Glycine 0 CA--C 1.535 1.287 0 C-N-CA 124.756 1.169 . . . . 0.0 113.756 -178.44 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 84.3 t -138.05 133.7 44.31 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.858 0 C-N-CA 125.747 1.619 . . . . 0.0 111.598 -176.291 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 70.2 t80 -69.27 141.75 54.29 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-N 119.742 1.156 . . . . 0.0 113.039 179.067 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -126.6 130.64 50.9 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.543 1.137 . . . . 0.0 111.445 172.788 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 80.9 mt-10 -71.72 -25.79 62.22 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 113.541 0.941 . . . . 0.0 113.541 176.848 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -74.23 -42.13 60.23 Favored 'General case' 0 N--CA 1.479 1.023 0 CA-C-N 118.98 0.809 . . . . 0.0 111.481 177.859 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 33.1 m -75.11 -31.57 61.17 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 124.302 1.041 . . . . 0.0 112.029 171.037 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 71.39 22.25 78.59 Favored Glycine 0 CA--C 1.534 1.226 0 C-N-CA 123.959 0.79 . . . . 0.0 112.265 -169.74 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -153.82 166.95 31.29 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 126.382 1.873 . . . . 0.0 112.13 -169.406 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 70.2 m95 -76.69 142.99 40.34 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.728 1.211 . . . . 0.0 111.893 175.718 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 28.9 m -139.74 148.09 23.4 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 C-N-CA 126.663 1.985 . . . . 0.0 112.086 -172.906 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 4.7 m0 -97.71 98.98 10.33 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 127.386 2.275 . . . . 0.0 107.598 170.851 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 66.3 mttm -75.22 154.4 37.57 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 124.412 1.085 . . . . 0.0 111.525 179.808 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 62.1 t30 49.59 40.23 19.0 Favored 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 125.087 1.355 . . . . 0.0 112.411 -174.509 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 96.8 m -130.12 137.94 50.41 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 124.835 1.254 . . . . 0.0 111.383 -175.921 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 11.1 tt -133.75 140.13 47.2 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 C-N-CA 126.363 1.865 . . . . 0.0 112.121 -168.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 69.2 tt0 -97.51 132.34 43.29 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.502 1.121 . . . . 0.0 110.621 169.863 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 7.7 p -145.79 127.57 8.35 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.616 0 C-N-CA 125.352 1.461 . . . . 0.0 111.02 171.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 61.9 m-20 53.3 36.81 23.75 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 124.993 1.317 . . . . 0.0 113.828 175.372 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 79.67 8.5 87.67 Favored Glycine 0 CA--C 1.539 1.575 0 C-N-CA 124.67 1.129 . . . . 0.0 115.383 -179.368 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 58.9 mtmt -123.5 160.69 26.41 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 126.29 1.836 . . . . 0.0 111.114 178.247 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 75.3 m-85 -113.27 143.19 44.84 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 124.177 0.991 . . . . 0.0 113.635 179.832 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 21.5 m-30 -139.93 171.82 13.66 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 128.247 2.619 . . . . 0.0 109.77 179.709 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 596' ' ' HIS . . . . . . . . . . . . . 20.0 m80 -83.79 143.05 30.22 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 107.976 -1.12 . . . . 0.0 107.976 166.409 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 11.3 m -65.26 -41.35 94.35 Favored 'General case' 0 N--CA 1.473 0.68 0 O-C-N 122.089 -0.382 . . . . 0.0 111.897 -176.72 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 21.3 p -65.55 -42.01 92.36 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-O 118.561 -0.733 . . . . 0.0 112.843 171.84 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 599' ' ' CYS . . . . . . . . . . . . . 67.4 m -59.83 -54.02 51.17 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 119.301 0.955 . . . . 0.0 111.605 178.883 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -54.73 -51.83 64.4 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 123.246 0.618 . . . . 0.0 109.929 175.093 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 85.8 t60 -56.71 -45.86 81.61 Favored 'General case' 0 N--CA 1.47 0.542 0 N-CA-C 114.222 1.193 . . . . 0.0 114.222 -179.607 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -80.49 -26.91 37.92 Favored 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 113.946 1.091 . . . . 0.0 113.946 -179.176 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 93.0 m . . . . . 0 N--CA 1.482 1.128 0 C-N-CA 123.936 0.895 . . . . 0.0 112.109 -177.854 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 22.3 mm . . . . . 0 N--CA 1.476 0.849 0 N-CA-C 113.032 0.753 . . . . 0.0 113.032 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 23.4 ptt180 -72.11 -17.79 61.95 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 113.661 0.986 . . . . 0.0 113.661 -176.625 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -75.62 -11.39 84.47 Favored Glycine 0 CA--C 1.535 1.33 0 C-N-CA 124.856 1.217 . . . . 0.0 114.165 -178.071 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -70.56 131.69 44.37 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 118.565 1.182 . . . . 0.0 110.732 174.766 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 50.0 p90 -140.58 163.94 31.51 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 124.79 1.236 . . . . 0.0 111.967 174.624 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 21.3 m -127.92 143.29 41.28 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 C-N-CA 126.004 1.721 . . . . 0.0 109.733 172.689 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 92.3 t -69.67 134.61 29.84 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.149 0 O-C-N 120.662 -1.274 . . . . 0.0 109.747 175.644 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 85.7 t -63.27 122.96 78.83 Favored Pre-proline 0 CA--C 1.544 0.746 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 179.137 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -72.85 151.07 50.61 Favored 'Trans proline' 0 CA--C 1.538 0.681 0 C-N-CA 122.572 2.182 . . . . 0.0 112.684 -175.595 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 16.0 pt-20 -62.61 -21.01 65.32 Favored 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 113.87 1.063 . . . . 0.0 113.87 179.359 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 45.8 p -74.68 -30.18 61.48 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 125.629 1.572 . . . . 0.0 113.208 176.014 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 62.3 m -87.19 79.76 8.49 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 123.617 0.767 . . . . 0.0 112.006 -177.911 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 85.9 mt-30 -58.4 -32.97 69.13 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 125.138 1.375 . . . . 0.0 113.501 -177.702 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 16.6 t0 -77.65 -12.47 59.97 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 124.764 1.226 . . . . 0.0 113.297 176.604 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 6.5 mtt 52.75 35.99 20.02 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 126.135 1.774 . . . . 0.0 113.364 -175.978 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -142.05 149.73 40.33 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.364 1.065 . . . . 0.0 112.47 -178.221 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 9.3 t80 -153.32 155.24 36.12 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 124.01 0.924 . . . . 0.0 110.825 177.329 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 28.3 ttpp -99.85 134.31 42.95 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 123.969 0.908 . . . . 0.0 113.27 -175.47 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 40.7 t -76.27 116.13 53.34 Favored Pre-proline 0 CA--C 1.541 0.614 0 C-N-CA 127.006 2.122 . . . . 0.0 110.622 169.286 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -62.66 -28.31 76.67 Favored 'Trans proline' 0 CA--C 1.542 0.901 0 C-N-CA 122.708 2.272 . . . . 0.0 114.597 175.686 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 87.3 mt -70.6 -60.47 2.41 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.2 0 CA-C-N 118.845 0.748 . . . . 0.0 111.427 -174.54 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 15.6 p -93.72 -1.99 54.39 Favored 'General case' 0 CA--C 1.549 0.929 0 N-CA-C 113.596 0.961 . . . . 0.0 113.596 179.837 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 568' ' ' LYS . . . . . . . . . . . . . 2.2 mptp? 60.48 43.47 13.06 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 126.959 2.104 . . . . 0.0 112.205 -177.417 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 75.0 mm-40 -123.31 140.73 52.71 Favored 'General case' 0 N--CA 1.482 1.134 0 N-CA-C 114.401 1.26 . . . . 0.0 114.401 -173.645 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 97.5 m -82.06 116.74 21.79 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 123.863 0.865 . . . . 0.0 111.817 179.078 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 2.9 p -79.56 149.47 5.36 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.885 0 C-N-CA 124.411 1.084 . . . . 0.0 110.076 167.949 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 44.5 p -126.07 142.8 51.37 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 124.816 1.246 . . . . 0.0 111.319 -179.376 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -72.81 147.11 39.48 Favored Glycine 0 CA--C 1.529 0.932 0 C-N-CA 124.758 1.171 . . . . 0.0 112.893 -178.291 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 62.5 t -135.09 130.23 51.47 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.421 0 C-N-CA 124.583 1.153 . . . . 0.0 111.749 -178.979 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 68.5 t80 -68.39 115.78 8.21 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 122.993 0.517 . . . . 0.0 112.078 178.354 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 37.2 t0 -86.44 119.4 26.66 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 123.89 0.876 . . . . 0.0 110.006 169.386 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 63.7 mt-10 -69.25 -23.1 63.81 Favored 'General case' 0 CA--C 1.548 0.869 0 N-CA-C 113.2 0.815 . . . . 0.0 113.2 177.18 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 8.4 tm-20 -79.78 -47.76 14.69 Favored 'General case' 0 CA--C 1.541 0.61 0 O-C-N 121.211 -0.931 . . . . 0.0 111.724 -179.38 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 47.7 m -71.94 -28.42 63.45 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.775 0.83 . . . . 0.0 112.379 169.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 75.21 24.27 71.71 Favored Glycine 0 CA--C 1.533 1.212 0 C-N-CA 124.686 1.136 . . . . 0.0 113.933 -173.538 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -148.13 159.86 43.49 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 125.983 1.713 . . . . 0.0 111.812 -170.791 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 73.7 m95 -76.87 139.69 40.34 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 123.922 0.889 . . . . 0.0 111.731 -179.894 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 16.8 m -132.87 150.43 32.95 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 126.039 1.736 . . . . 0.0 112.591 -179.181 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 7.8 m0 -100.15 101.43 12.47 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 127.409 2.283 . . . . 0.0 107.829 173.079 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 73.8 mmtt -70.71 151.75 44.57 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 124.986 1.314 . . . . 0.0 111.56 -178.688 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 59.4 t30 49.57 40.4 19.3 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 125.442 1.497 . . . . 0.0 112.962 -177.862 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 99.9 m -123.86 147.74 47.37 Favored 'General case' 0 N--CA 1.485 1.309 0 O-C-N 121.005 -1.06 . . . . 0.0 112.476 -171.232 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 16.4 tt -142.55 148.73 19.67 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.631 0 C-N-CA 127.75 2.42 . . . . 0.0 110.049 -178.169 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 69.5 tt0 -108.34 130.47 55.2 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.421 1.088 . . . . 0.0 110.784 170.294 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 9.4 p -153.31 145.47 14.79 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.911 0 C-N-CA 125.06 1.344 . . . . 0.0 110.503 177.069 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 8.1 t-20 53.59 30.94 11.62 Favored 'General case' 0 CA--C 1.552 1.028 0 C-N-CA 124.944 1.297 . . . . 0.0 113.571 -177.655 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 76.6 11.22 85.43 Favored Glycine 0 CA--C 1.539 1.585 0 C-N-CA 124.976 1.274 . . . . 0.0 115.916 -179.323 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -135.25 161.03 36.55 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 125.914 1.686 . . . . 0.0 112.365 -179.75 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 69.6 m-85 -90.05 150.24 22.18 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 113.684 0.994 . . . . 0.0 113.684 178.258 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 89.1 m-85 -149.94 163.28 38.51 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 127.382 2.273 . . . . 0.0 109.955 -176.63 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 596' ' ' HIS . . . . . . . . . . . . . 29.4 m80 -81.07 140.61 35.0 Favored 'General case' 0 N--CA 1.471 0.602 0 O-C-N 121.343 -0.848 . . . . 0.0 109.224 168.716 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 23.6 t -62.62 -45.43 92.88 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 123.353 0.661 . . . . 0.0 112.02 -178.695 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 24.5 p -63.36 -44.34 95.1 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 123.871 0.868 . . . . 0.0 112.777 173.929 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 599' ' ' CYS . . . . . . . . . . . . . 97.2 m -57.77 -53.57 56.72 Favored 'General case' 0 CA--C 1.544 0.72 0 CA-C-N 119.134 0.879 . . . . 0.0 111.404 176.897 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 80.9 t80 -57.82 -45.79 85.63 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.335 1.054 . . . . 0.0 112.308 177.367 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 48.1 t-80 -62.9 -43.05 99.84 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 124.005 0.922 . . . . 0.0 113.011 177.628 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 62.9 mt-10 -73.0 -30.38 63.74 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 123.867 0.867 . . . . 0.0 113.117 178.342 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 51.5 m . . . . . 0 N--CA 1.477 0.921 0 C-N-CA 124.267 1.027 . . . . 0.0 112.13 175.01 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 24.0 mm . . . . . 0 N--CA 1.479 1.003 0 N-CA-C 111.324 0.12 . . . . 0.0 111.324 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 88.8 mtt-85 -70.1 -30.38 67.59 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 124.105 0.962 . . . . 0.0 112.959 176.905 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -79.73 -9.47 86.77 Favored Glycine 0 CA--C 1.536 1.369 0 C-N-CA 125.637 1.589 . . . . 0.0 114.535 178.572 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 58.9 mtpt -75.64 132.62 40.73 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.719 1.207 . . . . 0.0 111.154 177.063 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 23.5 p90 -153.3 166.55 32.24 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 125.234 1.414 . . . . 0.0 111.387 176.141 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -130.89 133.72 62.69 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 C-N-CA 124.915 1.286 . . . . 0.0 110.483 175.671 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 73.4 t -64.15 134.34 29.04 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 C-N-CA 124.168 0.987 . . . . 0.0 110.405 -178.152 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 59.0 t -70.97 116.5 47.07 Favored Pre-proline 0 CA--C 1.544 0.739 0 CA-C-O 118.627 -0.702 . . . . 0.0 109.467 173.741 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -83.37 154.8 14.21 Favored 'Trans proline' 0 N--CA 1.457 -0.642 0 C-N-CA 123.546 2.831 . . . . 0.0 111.607 179.949 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 3.9 pm0 -64.37 -22.39 66.94 Favored 'General case' 0 N--CA 1.471 0.577 0 O-C-N 121.089 -1.007 . . . . 0.0 112.675 174.435 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 67.6 p -71.85 -17.65 62.12 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 125.131 1.372 . . . . 0.0 113.064 175.936 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 61.0 p -74.05 -35.53 64.29 Favored 'General case' 0 N--CA 1.48 1.066 0 CA-C-N 119.278 0.945 . . . . 0.0 112.177 175.811 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 57.3 tt0 59.76 -49.17 0.08 Allowed 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 129.94 3.296 . . . . 0.0 115.994 -177.366 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 71.8 m-20 -80.23 -11.15 59.76 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.6 1.56 . . . . 0.0 113.883 177.719 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 63.5 mtp 57.59 27.19 13.8 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 125.889 1.675 . . . . 0.0 114.517 -179.3 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -145.83 147.65 32.05 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.327 1.051 . . . . 0.0 113.483 -175.421 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 40.2 m-85 -149.79 164.97 33.87 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 127.051 2.14 . . . . 0.0 110.276 175.304 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 38.1 ttmt -114.09 132.04 56.18 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 124.496 1.119 . . . . 0.0 112.815 -177.881 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 13.1 t -66.94 112.67 10.34 Favored Pre-proline 0 CA--C 1.542 0.655 0 C-N-CA 126.284 1.834 . . . . 0.0 109.744 168.437 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -70.16 -18.87 34.84 Favored 'Trans proline' 0 CA--C 1.54 0.796 0 C-N-CA 122.5 2.134 . . . . 0.0 113.024 176.494 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 36.5 mt -70.93 -50.11 45.32 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 C-N-CA 124.839 1.256 . . . . 0.0 110.968 -175.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 15.6 p -108.55 -2.09 19.15 Favored 'General case' 0 CA--C 1.552 1.028 0 C-N-CA 124.906 1.283 . . . . 0.0 113.607 178.425 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 568' ' ' LYS . . . . . . . . . . . . . 96.0 mttt 60.44 46.59 9.63 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 126.913 2.085 . . . . 0.0 112.697 -177.507 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 72.1 mm-40 -126.04 141.88 51.76 Favored 'General case' 0 N--CA 1.481 1.078 0 N-CA-C 114.688 1.366 . . . . 0.0 114.688 -176.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 93.7 m -86.23 130.56 34.48 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 123.781 0.832 . . . . 0.0 112.979 -176.535 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 3.0 m -94.78 151.43 3.82 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.891 0 C-N-CA 125.779 1.631 . . . . 0.0 111.088 167.514 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 65.8 p -134.15 149.52 51.05 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 125.414 1.486 . . . . 0.0 111.27 178.158 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -67.69 143.8 42.67 Favored Glycine 0 CA--C 1.536 1.363 0 C-N-CA 124.219 0.914 . . . . 0.0 114.868 -177.42 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 98.8 t -139.67 136.0 39.51 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 125.596 1.558 . . . . 0.0 112.091 -179.703 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 75.2 t80 -73.25 123.58 23.99 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 120.241 1.382 . . . . 0.0 112.97 -177.262 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 16.1 t0 -91.62 123.01 34.7 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 125.641 1.576 . . . . 0.0 111.274 169.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -72.37 -24.59 61.29 Favored 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 114.131 1.16 . . . . 0.0 114.131 177.125 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -73.84 -53.74 9.55 Favored 'General case' 0 N--CA 1.476 0.826 0 CA-C-N 119.09 0.859 . . . . 0.0 111.661 -176.299 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 15.4 t -78.6 -27.46 45.55 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 123.831 0.853 . . . . 0.0 112.201 172.749 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 79.45 32.54 37.83 Favored Glycine 0 CA--C 1.532 1.144 0 C-N-CA 124.032 0.825 . . . . 0.0 113.2 -175.754 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 77.6 mm-40 -141.49 155.92 45.79 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.73 1.612 . . . . 0.0 111.777 -170.421 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 79.7 m95 -76.08 138.32 40.74 Favored 'General case' 0 CA--C 1.534 0.358 0 O-C-N 120.967 -1.083 . . . . 0.0 111.468 173.584 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 18.7 m -138.8 151.03 23.62 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.019 0 C-N-CA 126.657 1.983 . . . . 0.0 113.002 -173.273 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 4.3 m0 -94.93 104.19 16.07 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 126.376 1.87 . . . . 0.0 108.639 168.632 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 53.9 mtmt -69.5 145.87 52.34 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 124.305 1.042 . . . . 0.0 111.443 -177.487 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 48.0 t30 48.96 44.76 22.65 Favored 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 125.326 1.45 . . . . 0.0 112.194 -178.236 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 87.9 m -131.77 146.35 52.1 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 124.528 1.131 . . . . 0.0 111.993 -173.058 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 13.0 tt -139.66 151.79 22.53 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.724 0 C-N-CA 127.967 2.507 . . . . 0.0 109.979 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 81.0 tt0 -107.93 117.77 35.01 Favored 'General case' 0 N--CA 1.472 0.67 0 O-C-N 120.889 -1.132 . . . . 0.0 110.734 172.099 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 5.0 t -144.18 138.38 24.13 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 C-N-CA 125.511 1.524 . . . . 0.0 110.506 -175.567 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 14.5 m120 54.39 34.49 20.9 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 124.973 1.309 . . . . 0.0 113.678 -179.57 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 75.77 11.27 84.68 Favored Glycine 0 CA--C 1.536 1.4 0 C-N-CA 124.773 1.178 . . . . 0.0 115.58 -179.329 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 64.1 mttp -132.21 157.08 45.24 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 125.96 1.704 . . . . 0.0 111.614 -179.298 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 74.8 m-85 -88.38 130.97 35.02 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 121.685 0.755 . . . . 0.0 111.566 174.241 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 12.1 m-30 -124.72 156.68 37.25 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 127.104 2.162 . . . . 0.0 109.696 -176.523 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 596' ' ' HIS . . . . . . . . . . . . . 29.6 m80 -79.87 140.98 36.55 Favored 'General case' 0 N--CA 1.47 0.573 0 O-C-N 120.837 -1.164 . . . . 0.0 108.184 167.085 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 19.1 m -66.8 -38.31 86.26 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 118.841 0.746 . . . . 0.0 112.262 -179.251 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 23.4 p -65.65 -37.86 87.72 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 123.872 0.869 . . . . 0.0 113.187 172.042 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 599' ' ' CYS . . . . . . . . . . . . . 68.0 m -61.71 -58.63 7.28 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 123.881 0.872 . . . . 0.0 110.089 172.7 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 58.1 t80 -53.48 -39.64 64.69 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 125.329 1.452 . . . . 0.0 113.517 -179.782 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 82.1 t60 -60.79 -27.16 67.81 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 113.85 1.056 . . . . 0.0 113.85 177.619 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 57.7 mm-40 -109.36 -7.95 15.14 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 125.571 1.549 . . . . 0.0 114.258 -179.958 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 19.3 m . . . . . 0 N--CA 1.476 0.85 0 C-N-CA 124.572 1.149 . . . . 0.0 113.082 -173.857 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 34.9 mm . . . . . 0 CA--C 1.547 0.835 0 N-CA-C 111.824 0.305 . . . . 0.0 111.824 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . 0.269 0.0 OUTLIER -76.27 -13.94 60.14 Favored 'General case' 0 N--CA 1.486 1.347 0 O-C-N 120.505 -1.372 . . . . 0.0 113.54 175.856 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -70.6 -12.95 70.91 Favored Glycine 0 CA--C 1.537 1.414 0 C-N-CA 124.751 1.167 . . . . 0.0 113.9 170.914 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 32.0 mmtp -75.03 127.6 33.61 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 118.767 1.283 . . . . 0.0 110.364 171.245 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 39.9 p90 -149.62 164.24 35.68 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 123.854 0.861 . . . . 0.0 112.713 173.737 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -134.24 133.15 55.63 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 C-N-CA 126.15 1.78 . . . . 0.0 109.644 174.634 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 53.8 t -67.23 135.28 28.83 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.94 0 C-N-CA 123.774 0.83 . . . . 0.0 110.834 -176.72 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 19.0 t -74.28 116.21 50.58 Favored Pre-proline 0 N--CA 1.474 0.729 0 N-CA-C 108.518 -0.919 . . . . 0.0 108.518 171.523 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_endo -77.05 151.13 30.33 Favored 'Trans proline' 0 N--CA 1.458 -0.586 0 C-N-CA 122.752 2.301 . . . . 0.0 111.302 175.456 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -62.65 -22.36 66.38 Favored 'General case' 0 N--CA 1.477 0.876 0 O-C-N 121.376 -0.827 . . . . 0.0 112.942 175.069 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 20.6 m -64.32 -28.32 69.63 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 125.353 1.461 . . . . 0.0 113.487 171.685 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 42.3 t -78.14 125.97 30.13 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 123.934 0.894 . . . . 0.0 112.181 179.639 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 1.7 pm0 -81.31 152.66 27.45 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.363 1.065 . . . . 0.0 111.868 170.197 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 36.3 m-20 60.75 -11.93 0.05 OUTLIER 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 127.642 2.377 . . . . 0.0 117.365 176.848 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 46.9 mtp 57.34 32.76 22.29 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 126.098 1.759 . . . . 0.0 114.194 173.448 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -151.33 155.54 38.92 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.827 1.251 . . . . 0.0 112.797 -171.674 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -152.97 154.44 34.99 Favored 'General case' 0 CA--C 1.542 0.673 0 N-CA-C 113.09 0.774 . . . . 0.0 113.09 173.237 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 14.5 tptm -77.88 142.0 38.74 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 125.107 1.363 . . . . 0.0 113.226 -178.116 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 14.8 t -94.45 107.25 28.47 Favored Pre-proline 0 CA--C 1.539 0.554 0 C-N-CA 125.165 1.386 . . . . 0.0 108.979 167.736 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 63.9 Cg_endo -67.66 -19.58 47.67 Favored 'Trans proline' 0 CA--C 1.542 0.905 0 C-N-CA 122.162 1.908 . . . . 0.0 113.529 175.851 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 89.0 mt -73.48 -56.86 8.12 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 C-N-CA 124.365 1.066 . . . . 0.0 111.178 -176.473 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 14.9 p -100.17 0.3 40.25 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 124.488 1.115 . . . . 0.0 113.794 179.242 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 568' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 59.58 44.32 14.73 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 126.818 2.047 . . . . 0.0 112.122 -179.423 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 74.7 mm-40 -115.59 -175.35 2.7 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 123.774 0.83 . . . . 0.0 112.154 179.857 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 60.6 m -125.6 128.66 48.24 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 124.403 1.081 . . . . 0.0 110.586 172.078 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 2.3 p -91.83 147.15 5.49 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 C-N-CA 124.357 1.063 . . . . 0.0 111.062 170.161 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 64.3 p -133.4 145.91 50.74 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 124.826 1.25 . . . . 0.0 111.753 -175.299 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -72.04 153.6 49.98 Favored Glycine 0 CA--C 1.537 1.413 0 C-N-CA 124.275 0.941 . . . . 0.0 113.63 -179.939 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 8.8 p -142.69 138.06 28.13 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 C-N-CA 124.362 1.065 . . . . 0.0 112.383 177.972 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 68.9 t80 -71.71 118.37 14.46 Favored 'General case' 0 CA--C 1.544 0.732 0 O-C-N 121.497 -0.752 . . . . 0.0 112.295 -178.364 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 21.8 t0 -85.22 120.9 27.23 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.32 1.048 . . . . 0.0 110.493 170.158 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 53.2 mt-10 -74.36 -22.91 59.0 Favored 'General case' 0 CA--C 1.54 0.565 0 N-CA-C 113.765 1.024 . . . . 0.0 113.765 -178.812 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 34.1 mm-40 -76.52 -51.17 12.22 Favored 'General case' 0 N--CA 1.476 0.849 0 CA-C-N 119.467 1.03 . . . . 0.0 112.998 177.203 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 15.7 t -75.07 -27.44 59.94 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 123.47 0.708 . . . . 0.0 112.071 173.736 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 75.49 32.18 55.32 Favored Glycine 0 CA--C 1.535 1.324 0 C-N-CA 124.829 1.204 . . . . 0.0 112.655 -175.002 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -143.94 150.44 38.35 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 125.506 1.522 . . . . 0.0 112.133 -170.863 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 84.7 m95 -73.71 138.97 45.0 Favored 'General case' 0 CA--C 1.537 0.474 0 O-C-N 121.288 -0.883 . . . . 0.0 111.904 175.429 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 5.5 m -134.84 141.58 42.72 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 C-N-CA 126.115 1.766 . . . . 0.0 112.9 -177.419 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 4.7 m0 -87.51 102.94 15.06 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.739 1.616 . . . . 0.0 108.854 169.338 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 73.5 mmtt -72.8 147.54 45.4 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 123.867 0.867 . . . . 0.0 111.628 -178.581 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 51.3 t30 50.45 43.76 27.0 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.959 1.304 . . . . 0.0 112.271 -177.983 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 93.0 m -126.2 147.19 49.71 Favored 'General case' 0 N--CA 1.48 1.057 0 O-C-N 120.774 -1.203 . . . . 0.0 112.899 -172.095 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 5.6 tt -139.65 144.87 27.75 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.672 0 C-N-CA 127.663 2.385 . . . . 0.0 109.668 179.964 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 87.0 tt0 -117.46 121.04 39.96 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 124.977 1.311 . . . . 0.0 110.198 173.47 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 5.2 t -142.88 131.16 19.96 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.509 0 C-N-CA 125.96 1.704 . . . . 0.0 109.746 -175.164 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 71.5 m-20 52.22 44.72 29.45 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 125.223 1.409 . . . . 0.0 112.737 174.953 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 73.33 9.85 77.93 Favored Glycine 0 CA--C 1.536 1.363 0 C-N-CA 125.157 1.36 . . . . 0.0 115.507 178.915 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 35.9 mtmm -128.58 151.86 48.97 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 126.085 1.754 . . . . 0.0 112.007 -176.415 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 69.4 m-85 -96.72 148.59 22.73 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 124.098 0.959 . . . . 0.0 112.88 174.211 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 65.3 m-85 -149.13 160.1 43.65 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.177 1.391 . . . . 0.0 110.578 177.748 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 596' ' ' HIS . . . . . . . . . . . . . 20.8 m170 -75.19 142.23 43.5 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 167.628 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 8.7 t -67.54 -42.23 83.0 Favored 'General case' 0 N--CA 1.469 0.505 0 O-C-N 121.388 -0.82 . . . . 0.0 111.867 -179.273 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 21.6 p -60.32 -38.76 84.74 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.661 0.785 . . . . 0.0 113.096 173.471 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 599' ' ' CYS . . . . . . . . . . . . . 95.1 m -68.35 -57.61 5.65 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.161 0.984 . . . . 0.0 110.727 177.385 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 54.7 t80 -65.56 -33.51 76.09 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 113.064 0.764 . . . . 0.0 113.064 -175.246 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 82.0 t60 -58.18 -36.88 73.71 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 124.742 1.217 . . . . 0.0 113.108 175.315 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 94.8 mt-10 -89.78 -26.26 20.68 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 113.648 0.981 . . . . 0.0 113.648 176.329 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 83.0 m . . . . . 0 N--CA 1.478 0.942 0 C-N-CA 124.121 0.968 . . . . 0.0 113.096 -175.037 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 5.9 mm . . . . . 0 N--CA 1.478 0.928 0 CA-C-O 120.513 0.197 . . . . 0.0 111.212 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 38.4 ptt180 -64.4 -22.68 67.03 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 125.145 1.378 . . . . 0.0 114.148 176.816 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -81.25 -9.36 86.11 Favored Glycine 0 CA--C 1.533 1.164 0 C-N-CA 125.63 1.586 . . . . 0.0 114.47 -177.597 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -70.45 143.62 51.72 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 118.348 1.074 . . . . 0.0 110.684 173.336 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 38.9 p90 -151.46 165.68 33.44 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 124.09 0.956 . . . . 0.0 112.528 177.576 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -131.16 134.14 61.68 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 C-N-CA 125.612 1.565 . . . . 0.0 110.137 174.326 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 10.8 p -70.6 133.67 31.43 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 C-N-CA 123.723 0.809 . . . . 0.0 110.965 -176.164 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 5.1 t -85.24 120.26 73.18 Favored Pre-proline 0 C--O 1.238 0.493 0 C-N-CA 125.101 1.36 . . . . 0.0 110.321 173.824 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -76.5 146.25 27.29 Favored 'Trans proline' 0 C--N 1.352 0.713 0 C-N-CA 122.28 1.987 . . . . 0.0 111.146 169.583 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -62.92 -23.49 67.39 Favored 'General case' 0 N--CA 1.476 0.858 0 O-C-N 121.444 -0.785 . . . . 0.0 112.794 179.283 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 67.7 p -68.73 -18.23 64.2 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 125.49 1.516 . . . . 0.0 113.934 172.851 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 15.3 t -74.99 43.17 0.2 Allowed 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 124.881 1.272 . . . . 0.0 114.271 174.758 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 55.6 tt0 46.84 -99.13 0.04 OUTLIER 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 127.841 2.456 . . . . 0.0 114.226 170.121 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 79.7 m-20 -94.79 4.66 53.56 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 125.719 1.607 . . . . 0.0 114.712 -174.741 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 13.9 mtt 57.98 36.99 26.63 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 124.891 1.277 . . . . 0.0 114.083 -179.811 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -138.76 152.51 47.99 Favored 'General case' 0 CA--C 1.54 0.589 0 O-C-N 120.713 -1.242 . . . . 0.0 114.277 -176.584 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 17.6 t80 -151.06 174.15 13.52 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 126.139 1.776 . . . . 0.0 109.391 172.615 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 7.0 ttpm? -125.0 129.51 50.46 Favored 'General case' 0 N--CA 1.481 1.106 0 CA-C-N 120.702 1.592 . . . . 0.0 112.846 179.222 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 49.0 t -65.07 117.79 42.97 Favored Pre-proline 0 CA--C 1.538 0.482 0 C-N-CA 126.521 1.928 . . . . 0.0 111.032 172.778 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -63.96 -27.33 66.43 Favored 'Trans proline' 0 CA--C 1.54 0.791 0 C-N-CA 123.037 2.492 . . . . 0.0 115.114 176.437 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 97.0 mt -74.44 -55.18 12.83 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 124.174 0.989 . . . . 0.0 111.606 -172.492 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 15.3 p -100.74 -0.18 37.72 Favored 'General case' 0 CA--C 1.553 1.059 0 C-N-CA 124.287 1.035 . . . . 0.0 113.449 179.41 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 568' ' ' LYS . . . . . . . . . . . . . 1.6 mptp? 59.3 44.37 15.5 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 126.351 1.86 . . . . 0.0 112.041 -179.448 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 64.8 mm-40 -118.09 135.84 53.95 Favored 'General case' 0 N--CA 1.481 1.121 0 N-CA-C 114.312 1.227 . . . . 0.0 114.312 -173.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 94.0 m -76.13 116.11 16.51 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 123.427 0.691 . . . . 0.0 111.486 179.738 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 4.8 p -83.42 144.01 10.85 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.706 0 C-N-CA 124.49 1.116 . . . . 0.0 109.558 168.342 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 58.6 p -131.53 145.19 51.62 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 124.823 1.249 . . . . 0.0 110.692 178.82 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -68.7 138.01 31.21 Favored Glycine 0 CA--C 1.529 0.922 0 C-N-CA 124.327 0.965 . . . . 0.0 112.152 178.958 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 83.9 t -127.26 140.95 47.65 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.595 0 C-N-CA 124.583 1.153 . . . . 0.0 111.213 -176.586 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 65.9 t80 -64.91 124.2 21.42 Favored 'General case' 0 CA--C 1.545 0.784 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 -174.051 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 65.1 t0 -87.54 99.11 11.79 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 126.57 1.948 . . . . 0.0 109.803 172.269 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 -64.65 -24.45 67.59 Favored 'General case' 0 N--CA 1.473 0.712 0 N-CA-C 114.402 1.26 . . . . 0.0 114.402 -174.745 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 35.5 tp10 -75.34 -53.36 8.87 Favored 'General case' 0 N--CA 1.471 0.598 0 O-C-N 121.383 -0.823 . . . . 0.0 112.395 -179.187 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 65.2 m -87.74 -21.47 25.15 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 124.276 1.03 . . . . 0.0 113.189 179.5 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 79.91 30.35 43.42 Favored Glycine 0 CA--C 1.533 1.166 0 C-N-CA 124.712 1.149 . . . . 0.0 112.992 -175.382 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 79.2 mm-40 -111.33 -167.46 1.18 Allowed 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 125.861 1.664 . . . . 0.0 110.87 -177.5 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 73.3 m95 -125.41 145.89 49.86 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 125.399 1.48 . . . . 0.0 110.022 171.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 16.4 m -139.41 143.71 30.45 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.057 0 C-N-CA 124.838 1.255 . . . . 0.0 113.12 -172.135 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 12.3 m0 -94.35 102.05 14.03 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 126.036 1.735 . . . . 0.0 108.999 170.463 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 53.5 mtmt -74.14 151.13 40.13 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 125.828 1.651 . . . . 0.0 112.61 -177.275 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 54.3 t30 49.89 38.28 15.65 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 125.443 1.497 . . . . 0.0 112.825 -176.134 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 97.2 m -118.66 140.53 49.77 Favored 'General case' 0 N--CA 1.48 1.07 0 O-C-N 121.136 -0.978 . . . . 0.0 112.942 -172.212 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 14.0 tt -132.45 145.49 34.45 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.534 0 C-N-CA 127.729 2.412 . . . . 0.0 110.12 177.737 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 78.7 tt0 -108.86 131.99 54.46 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 124.861 1.264 . . . . 0.0 110.776 170.198 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 7.1 p -152.66 140.32 13.61 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 C-N-CA 124.786 1.235 . . . . 0.0 110.707 176.51 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 60.2 t30 53.4 37.68 26.1 Favored 'General case' 0 CA--C 1.553 1.084 0 C-N-CA 124.695 1.198 . . . . 0.0 113.21 179.268 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 73.35 10.2 78.49 Favored Glycine 0 CA--C 1.545 1.919 0 C-N-CA 124.828 1.204 . . . . 0.0 115.605 -179.678 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 55.4 mtmt -130.96 154.11 48.48 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 125.767 1.627 . . . . 0.0 111.979 -176.313 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 68.8 m-85 -92.91 149.56 21.17 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-O 121.949 0.88 . . . . 0.0 113.18 176.211 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -149.08 165.29 32.16 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 126.873 2.069 . . . . 0.0 109.489 -179.622 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 596' ' ' HIS . . . . . . . . . . . . . 26.1 m80 -83.52 141.49 31.59 Favored 'General case' 0 N--CA 1.467 0.388 0 O-C-N 121.68 -0.638 . . . . 0.0 109.58 168.424 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 15.3 m -64.93 -43.06 94.0 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 112.251 0.463 . . . . 0.0 112.251 -177.137 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 40.4 p -67.91 -41.75 82.19 Favored 'General case' 0 N--CA 1.481 1.104 0 N-CA-C 112.953 0.724 . . . . 0.0 112.953 175.769 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 599' ' ' CYS . . . . . . . . . . . . . 89.1 m -56.56 -54.37 46.69 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.489 1.116 . . . . 0.0 110.999 173.347 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 71.5 t80 -57.26 -45.06 84.36 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.166 0.987 . . . . 0.0 111.972 177.144 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 86.5 t60 -62.25 -42.53 99.4 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 114.071 1.137 . . . . 0.0 114.071 -179.194 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 75.1 mm-40 -80.21 -30.87 38.71 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 113.93 1.085 . . . . 0.0 113.93 177.186 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 86.6 m . . . . . 0 N--CA 1.484 1.253 0 N-CA-C 113.357 0.873 . . . . 0.0 113.357 -171.842 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 31.4 mm . . . . . 0 N--CA 1.47 0.56 0 CA-C-O 120.371 0.129 . . . . 0.0 111.022 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -69.93 -28.5 65.63 Favored 'General case' 0 N--CA 1.481 1.083 0 O-C-N 121.459 -0.775 . . . . 0.0 112.444 174.58 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -76.45 -9.08 86.08 Favored Glycine 0 CA--C 1.539 1.536 0 C-N-CA 125.435 1.493 . . . . 0.0 115.042 176.623 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 9.7 mmpt? -67.19 141.41 57.33 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-N 119.477 1.639 . . . . 0.0 111.14 172.349 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 51.5 p90 -153.79 164.83 37.68 Favored 'General case' 0 C--O 1.24 0.563 0 C-N-CA 124.354 1.062 . . . . 0.0 112.27 170.854 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 6.5 m -129.74 137.15 57.43 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 C-N-CA 126.19 1.796 . . . . 0.0 108.971 169.493 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 9.2 p -66.49 134.84 29.46 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.923 0 O-C-N 121.167 -0.958 . . . . 0.0 110.043 -179.312 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 3.3 t -88.09 114.55 59.82 Favored Pre-proline 0 CA--C 1.54 0.567 0 C-N-CA 123.68 0.792 . . . . 0.0 109.112 174.564 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 95.5 Cg_endo -74.29 162.97 37.45 Favored 'Trans proline' 0 CA--C 1.534 0.503 0 C-N-CA 122.704 2.269 . . . . 0.0 112.937 -178.826 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 17.1 pt-20 -66.0 -19.56 65.9 Favored 'General case' 0 N--CA 1.477 0.904 0 O-C-N 121.318 -0.864 . . . . 0.0 113.022 172.148 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 76.7 p -80.91 -6.07 58.22 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 126.057 1.743 . . . . 0.0 113.685 172.103 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 44.1 t -60.28 148.02 38.19 Favored 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 114.333 1.234 . . . . 0.0 114.333 -179.168 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 7.2 pt20 -74.32 88.05 2.03 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.953 1.301 . . . . 0.0 111.577 170.955 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 26.6 m-20 56.33 19.28 3.88 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 126.479 1.912 . . . . 0.0 115.175 176.313 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 10.5 mtt 55.75 30.98 16.63 Favored 'General case' 0 N--CA 1.472 0.625 0 N-CA-C 115.259 1.577 . . . . 0.0 115.259 -174.217 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -133.92 139.28 46.04 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.304 1.042 . . . . 0.0 112.637 -178.713 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 5.7 t80 -154.31 159.49 41.25 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 123.361 0.665 . . . . 0.0 112.107 177.74 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -88.88 152.44 21.74 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 125.465 1.506 . . . . 0.0 114.106 -172.74 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 25.3 t -104.16 104.41 43.76 Favored Pre-proline 0 CA--C 1.547 0.863 0 C-N-CA 126.615 1.966 . . . . 0.0 109.347 166.117 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -62.16 -23.49 75.53 Favored 'Trans proline' 0 CA--C 1.54 0.803 0 C-N-CA 123.243 2.629 . . . . 0.0 115.258 178.314 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 79.0 mt -72.96 -54.52 15.59 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 C-N-CA 124.089 0.956 . . . . 0.0 111.044 -176.749 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 14.1 p -102.8 1.19 33.84 Favored 'General case' 0 CA--C 1.551 1.014 0 N-CA-C 113.807 1.04 . . . . 0.0 113.807 -178.409 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 568' ' ' LYS . . . . . . . . . . . . 0.304 0.0 OUTLIER 55.73 43.71 27.45 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 127.808 2.443 . . . . 0.0 113.688 -175.909 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 70.9 mm-40 -110.88 -177.58 3.25 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.096 0.558 . . . . 0.0 112.41 179.568 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 99.1 m -125.9 126.72 44.87 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 124.817 1.247 . . . . 0.0 111.346 177.793 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 1.2 m -87.61 144.7 8.69 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.775 0 C-N-CA 124.645 1.178 . . . . 0.0 110.61 168.681 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 51.4 p -130.63 144.1 51.19 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 124.42 1.088 . . . . 0.0 111.296 176.438 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -67.54 152.81 52.8 Favored Glycine 0 CA--C 1.535 1.294 0 C-N-CA 124.201 0.905 . . . . 0.0 113.845 179.715 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 8.9 p -137.6 142.08 37.53 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 C-N-CA 125.177 1.391 . . . . 0.0 112.14 176.345 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 75.6 t80 -77.21 123.11 25.99 Favored 'General case' 0 CA--C 1.542 0.667 0 O-C-N 120.618 -1.301 . . . . 0.0 112.984 -173.214 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 24.3 t0 -90.08 118.14 29.39 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 124.67 1.188 . . . . 0.0 111.427 169.217 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 63.2 mt-10 -71.84 -27.75 63.1 Favored 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 113.656 0.984 . . . . 0.0 113.656 -178.788 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -75.31 -50.27 16.56 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 123.797 0.839 . . . . 0.0 111.998 -178.398 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 13.0 t -74.18 -28.98 61.54 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.461 0.705 . . . . 0.0 112.268 171.933 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 76.57 29.35 58.0 Favored Glycine 0 CA--C 1.536 1.39 0 C-N-CA 123.651 0.643 . . . . 0.0 112.721 -174.905 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 79.4 mm-40 -141.65 157.48 45.03 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 125.454 1.501 . . . . 0.0 111.106 -173.154 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 75.7 m95 -79.63 146.62 32.41 Favored 'General case' 0 N--CA 1.47 0.554 0 O-C-N 121.157 -0.964 . . . . 0.0 112.007 177.359 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 8.5 m -135.05 138.89 48.22 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 C-N-CA 126.249 1.82 . . . . 0.0 112.433 -177.068 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 0.8 OUTLIER -90.4 100.21 13.09 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 126.062 1.745 . . . . 0.0 107.23 170.229 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 42.7 mtmt -75.48 150.32 38.25 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 123.861 0.864 . . . . 0.0 112.367 179.088 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 54.1 t30 51.45 40.23 26.26 Favored 'General case' 0 CA--C 1.551 1.01 0 C-N-CA 125.627 1.571 . . . . 0.0 112.43 -174.666 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 80.6 m -125.21 145.88 49.77 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 124.149 0.98 . . . . 0.0 112.895 -174.584 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 8.4 tt -142.81 148.16 20.0 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 C-N-CA 127.577 2.351 . . . . 0.0 110.743 -178.825 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 60.4 tt0 -110.38 126.15 53.97 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 125.24 1.416 . . . . 0.0 109.539 169.683 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 2.2 t -142.99 129.57 17.61 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 C-N-CA 126.322 1.849 . . . . 0.0 109.809 -177.041 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 70.1 m-20 52.78 37.09 22.97 Favored 'General case' 0 CA--C 1.551 1.01 0 C-N-CA 125.064 1.346 . . . . 0.0 114.073 174.39 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 79.59 8.21 87.91 Favored Glycine 0 CA--C 1.536 1.397 0 C-N-CA 124.853 1.216 . . . . 0.0 115.485 -179.557 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 56.6 mtmt -127.54 155.46 43.76 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 125.878 1.671 . . . . 0.0 111.408 178.029 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 65.6 m-85 -98.87 149.45 22.9 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 123.905 0.882 . . . . 0.0 112.424 175.996 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 93.5 m-85 -150.58 162.04 41.42 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 126.087 1.755 . . . . 0.0 111.547 -174.924 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 596' ' ' HIS . . . . . . . . . . . . . 18.3 m80 -74.69 141.01 44.57 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 166.935 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 9.2 t -65.09 -40.36 94.49 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 118.219 0.463 . . . . 0.0 111.504 177.471 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 21.4 p -60.67 -45.32 94.59 Favored 'General case' 0 N--CA 1.478 0.938 0 N-CA-C 114.062 1.134 . . . . 0.0 114.062 172.001 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 599' ' ' CYS . . . . . . . . . . . . . 98.9 m -62.13 -51.52 67.56 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 123.884 0.874 . . . . 0.0 111.837 177.551 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 68.5 t80 -61.27 -41.97 97.85 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 123.599 0.759 . . . . 0.0 112.012 177.659 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 23.8 t-80 -68.01 -35.14 77.79 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 123.886 0.875 . . . . 0.0 113.263 178.238 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 31.8 tp10 -69.8 -34.21 73.41 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 124.514 1.125 . . . . 0.0 112.384 172.161 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 95.8 m . . . . . 0 N--CA 1.48 1.037 0 C-N-CA 124.122 0.969 . . . . 0.0 111.765 173.513 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 33.2 mm . . . . . 0 N--CA 1.477 0.881 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.16 -8.99 56.36 Favored 'General case' 0 N--CA 1.48 1.038 0 N-CA-C 113.883 1.068 . . . . 0.0 113.883 177.988 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -77.69 -12.58 84.34 Favored Glycine 0 CA--C 1.537 1.447 0 C-N-CA 124.677 1.132 . . . . 0.0 114.523 170.301 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -69.75 135.33 49.62 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 118.769 1.284 . . . . 0.0 113.003 -178.462 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 42.7 p90 -154.74 162.82 40.97 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 124.737 1.215 . . . . 0.0 112.538 169.979 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -136.07 133.03 50.43 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.581 0 C-N-CA 126.246 1.819 . . . . 0.0 109.925 179.84 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 9.9 p -67.37 138.94 21.8 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.135 0 C-N-CA 123.633 0.773 . . . . 0.0 111.64 -175.868 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 61.6 t -76.24 115.74 49.77 Favored Pre-proline 0 N--CA 1.473 0.681 0 C-N-CA 124.53 1.132 . . . . 0.0 108.752 169.835 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -79.49 157.72 25.43 Favored 'Trans proline' 0 CA--C 1.54 0.791 0 C-N-CA 122.965 2.443 . . . . 0.0 111.972 176.914 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -64.63 -24.36 67.56 Favored 'General case' 0 CA--C 1.55 0.97 0 N-CA-C 113.414 0.894 . . . . 0.0 113.414 179.897 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 37.4 p -69.04 -37.36 78.55 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 125.557 1.543 . . . . 0.0 112.453 174.399 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 60.9 m -79.85 59.88 3.29 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.001 1.321 . . . . 0.0 111.046 171.267 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -65.7 -17.15 64.4 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 124.928 1.291 . . . . 0.0 114.131 -170.276 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 70.2 m-20 -73.85 -17.93 61.0 Favored 'General case' 0 N--CA 1.479 1.011 0 O-C-N 120.902 -1.124 . . . . 0.0 113.142 169.59 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 37.9 mtp 57.29 25.27 10.94 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 127.479 2.311 . . . . 0.0 115.102 176.886 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -140.96 152.82 45.28 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 124.319 1.048 . . . . 0.0 113.34 -175.073 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -156.1 160.66 40.14 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 126.45 1.9 . . . . 0.0 110.009 175.736 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 77.6 tttt -100.77 151.63 21.45 Favored 'General case' 0 N--CA 1.48 1.069 0 O-C-N 121.07 -1.019 . . . . 0.0 112.942 -179.455 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 49.0 t -92.22 110.27 43.33 Favored Pre-proline 0 CA--C 1.545 0.765 0 C-N-CA 127.374 2.27 . . . . 0.0 109.431 169.249 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -62.37 -15.37 44.63 Favored 'Trans proline' 0 CA--C 1.541 0.833 0 C-N-CA 123.919 3.08 . . . . 0.0 116.052 175.81 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 96.8 mt -80.05 -62.18 1.49 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.893 0 CA-C-N 119.311 0.959 . . . . 0.0 110.779 -179.239 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 14.7 p -96.96 -0.22 47.81 Favored 'General case' 0 CA--C 1.544 0.75 0 N-CA-C 113.947 1.092 . . . . 0.0 113.947 -177.521 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 568' ' ' LYS . . . . . . . . . . . . . 11.0 mptt 60.83 46.03 9.19 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 127.626 2.371 . . . . 0.0 111.707 -179.773 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 65.9 mm-40 -124.05 142.1 51.47 Favored 'General case' 0 N--CA 1.484 1.257 0 N-CA-C 114.947 1.462 . . . . 0.0 114.947 -175.085 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 88.4 m -87.71 122.41 31.35 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.794 0.838 . . . . 0.0 112.714 -177.42 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 2.9 m -81.98 151.13 4.27 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 C-N-CA 124.554 1.142 . . . . 0.0 110.007 167.243 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 57.6 p -131.96 147.97 52.49 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 124.728 1.211 . . . . 0.0 110.766 173.64 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -64.62 144.04 47.76 Favored Glycine 0 N--CA 1.468 0.825 0 C-N-CA 124.041 0.829 . . . . 0.0 113.775 -179.564 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 67.7 t -135.38 128.46 48.31 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.446 0 C-N-CA 125.575 1.55 . . . . 0.0 111.248 -179.52 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 88.3 t80 -67.59 115.72 7.5 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 121.687 -0.633 . . . . 0.0 112.278 -178.803 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -82.2 121.13 26.23 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 124.126 0.971 . . . . 0.0 110.234 169.888 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 53.0 mt-10 -70.72 -36.27 73.12 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.715 1.206 . . . . 0.0 113.841 -169.572 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -88.92 -33.93 17.1 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 119.041 0.837 . . . . 0.0 113.159 -178.586 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 19.3 m -72.24 -30.58 65.02 Favored 'General case' 0 N--CA 1.476 0.858 0 CA-C-N 118.421 0.555 . . . . 0.0 111.512 169.793 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 75.14 28.73 61.65 Favored Glycine 0 CA--C 1.535 1.289 0 C-N-CA 125.539 1.543 . . . . 0.0 113.562 -177.3 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 75.0 mm-40 -144.89 148.15 33.58 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 124.394 1.078 . . . . 0.0 112.246 -169.814 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 83.8 m95 -75.35 134.65 40.94 Favored 'General case' 0 C--N 1.327 -0.408 0 O-C-N 121.187 -0.946 . . . . 0.0 110.996 177.91 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 17.6 m -137.11 152.25 27.92 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 C-N-CA 126.359 1.864 . . . . 0.0 112.112 -173.704 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 5.8 m0 -93.96 102.64 14.74 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 126.011 1.724 . . . . 0.0 108.171 170.781 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 72.9 mmtt -78.12 145.44 35.73 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 124.408 1.083 . . . . 0.0 111.944 -178.431 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 60.08 37.64 20.93 Favored 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 125.097 1.359 . . . . 0.0 111.602 -175.691 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 26.8 m -128.7 149.02 50.86 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 124.783 1.233 . . . . 0.0 112.285 -171.222 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 17.3 tt -135.48 144.86 32.78 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 C-N-CA 127.507 2.323 . . . . 0.0 110.208 178.151 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 71.9 tt0 -106.15 125.63 51.23 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.478 1.111 . . . . 0.0 109.783 169.232 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 7.7 p -152.4 134.45 5.9 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.712 0 C-N-CA 124.589 1.155 . . . . 0.0 111.318 -175.826 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 70.9 m-20 53.27 35.29 19.73 Favored 'General case' 0 CA--C 1.553 1.093 0 C-N-CA 124.875 1.27 . . . . 0.0 114.266 -178.648 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 79.99 6.88 88.95 Favored Glycine 0 CA--C 1.538 1.529 0 C-N-CA 124.947 1.261 . . . . 0.0 115.64 179.727 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -130.43 158.39 40.03 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 125.388 1.475 . . . . 0.0 112.363 -179.383 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 78.3 m-85 -92.62 149.48 21.31 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-O 122.049 0.928 . . . . 0.0 113.02 176.222 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 77.2 m-85 -152.12 159.98 43.52 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 126.371 1.868 . . . . 0.0 109.746 -176.43 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 596' ' ' HIS . . . . . . . . . . . . . 28.8 m80 -76.76 140.2 40.69 Favored 'General case' 0 N--CA 1.473 0.694 0 O-C-N 120.915 -1.116 . . . . 0.0 108.369 167.82 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 53.1 p -63.76 -40.17 96.05 Favored 'General case' 0 N--CA 1.469 0.513 0 O-C-N 121.732 -0.605 . . . . 0.0 112.254 -177.74 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 7.2 p -69.39 -42.28 75.34 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 124.743 1.217 . . . . 0.0 113.157 174.844 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 599' ' ' CYS . . . . . . . . . . . . . 77.4 m -57.45 -54.95 41.05 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.304 1.042 . . . . 0.0 110.896 174.052 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 61.9 t80 -55.49 -49.01 73.66 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 124.09 0.956 . . . . 0.0 111.889 178.44 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 86.3 t60 -63.21 -40.32 97.15 Favored 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 113.114 0.783 . . . . 0.0 113.114 -178.795 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -71.45 -37.89 71.37 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 123.855 0.862 . . . . 0.0 112.657 176.83 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 91.6 m . . . . . 0 N--CA 1.476 0.857 0 C-N-CA 124.321 1.048 . . . . 0.0 113.549 -171.651 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 533' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.436 0 N-CA-C 111.551 -0.62 . . . . 0.0 111.551 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . -67.18 150.16 51.62 Favored Glycine 0 CA--C 1.537 1.408 0 CA-C-N 118.076 0.938 . . . . 0.0 113.416 175.799 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 535' ' ' SER . . . . . . . . . . . . . 61.0 p -70.16 -46.12 65.34 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 124.443 1.097 . . . . 0.0 112.332 178.825 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 536' ' ' GLU . . . . . . . . . . . . . 64.1 mt-10 -135.83 -21.88 1.45 Allowed 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 125.763 1.625 . . . . 0.0 113.56 175.84 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 537' ' ' PHE . . . . . . . . . . . . . 87.4 m-85 -70.82 142.7 51.27 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 124.023 0.929 . . . . 0.0 111.549 173.215 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 47.1 t -79.75 134.52 36.38 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 123.188 0.595 . . . . 0.0 111.594 171.026 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 539' ' ' ASP . . . . . . . . . . . . . 76.8 m-20 -87.71 0.25 55.97 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 124.659 1.183 . . . . 0.0 113.264 174.856 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 540' ' ' ARG . . . . . . . . . . . . . 76.8 mtp85 -77.98 31.17 0.17 Allowed 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 126.291 1.836 . . . . 0.0 114.646 -174.267 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 8.2 t 62.27 172.08 0.13 Allowed 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 127.766 2.426 . . . . 0.0 115.335 -177.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 542' ' ' ASN . . . . . . . . . . . . . 40.4 t30 -69.57 -12.63 61.8 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.754 1.622 . . . . 0.0 113.869 179.604 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 44.9 tp10 -54.58 -40.21 68.56 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 124.846 1.258 . . . . 0.0 113.106 -178.435 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 72.1 mt -77.46 -30.95 53.46 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 123.984 0.914 . . . . 0.0 112.866 176.752 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 37.9 tp10 -69.84 -30.48 67.98 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 124.313 1.045 . . . . 0.0 113.202 -174.808 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 18.0 mm -61.53 -43.01 96.18 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 123.552 0.741 . . . . 0.0 110.914 171.647 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 8.1 tmm_? -76.49 -23.83 53.79 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.919 1.288 . . . . 0.0 112.815 -177.243 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -71.45 -12.04 72.72 Favored Glycine 0 CA--C 1.541 1.689 0 C-N-CA 124.721 1.153 . . . . 0.0 115.579 175.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 71.8 mmtt -68.23 152.54 45.31 Favored 'General case' 0 N--CA 1.476 0.864 0 CA-C-N 119.108 1.454 . . . . 0.0 112.79 178.787 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 51.1 p90 -154.82 166.12 34.47 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 124.867 1.267 . . . . 0.0 112.629 172.796 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 1.6 m -135.35 140.2 45.32 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.885 0 C-N-CA 126.326 1.851 . . . . 0.0 110.294 175.767 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 78.8 t -69.07 130.9 34.22 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.232 0 O-C-N 121.297 -0.877 . . . . 0.0 111.278 -177.462 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 11.2 t -79.26 122.44 84.16 Favored Pre-proline 0 CA--C 1.541 0.602 0 C-N-CA 124.183 0.993 . . . . 0.0 110.01 172.286 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -75.8 156.39 39.46 Favored 'Trans proline' 0 CA--C 1.537 0.663 0 C-N-CA 122.56 2.173 . . . . 0.0 112.251 176.484 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 15.7 pm0 -66.43 -17.25 64.68 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 124.295 1.038 . . . . 0.0 113.493 174.205 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 74.2 p -81.34 -9.28 59.78 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 125.891 1.677 . . . . 0.0 113.06 172.726 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 43.9 t -59.79 141.15 55.84 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 119.293 0.951 . . . . 0.0 113.225 179.451 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 88.3 mm-40 -75.11 97.13 3.38 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 124.115 0.966 . . . . 0.0 110.132 173.02 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 30.0 m-20 55.25 25.62 7.57 Favored 'General case' 0 CA--C 1.554 1.107 0 C-N-CA 126.288 1.835 . . . . 0.0 114.808 177.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 8.1 mtt 57.32 32.99 22.65 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 125.6 1.56 . . . . 0.0 114.707 179.391 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -137.8 149.4 46.34 Favored 'General case' 0 CA--C 1.538 0.489 0 N-CA-C 115.058 1.503 . . . . 0.0 115.058 -173.39 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 24.5 m-85 -149.25 165.68 31.19 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 127.34 2.256 . . . . 0.0 110.014 171.322 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 19.7 ttmm -117.95 133.9 55.47 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 123.928 0.891 . . . . 0.0 112.317 -179.092 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 14.4 t -73.59 111.73 13.26 Favored Pre-proline 0 CA--C 1.547 0.856 0 C-N-CA 127.045 2.138 . . . . 0.0 110.483 170.487 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 79.9 Cg_endo -70.64 -15.41 33.79 Favored 'Trans proline' 0 CA--C 1.542 0.913 0 C-N-CA 122.728 2.285 . . . . 0.0 114.132 175.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 93.0 mt -73.7 -56.12 10.33 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.823 0 C-N-CA 124.307 1.043 . . . . 0.0 110.924 -178.866 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 13.8 p -102.38 -1.68 30.36 Favored 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 124.752 1.221 . . . . 0.0 113.901 -179.816 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 568' ' ' LYS . . . . . . . . . . . . . 33.1 mmtp 62.65 41.67 9.08 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 127.072 2.149 . . . . 0.0 113.462 -178.173 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 75.0 mm-40 -122.76 145.62 48.25 Favored 'General case' 0 N--CA 1.482 1.175 0 N-CA-C 113.841 1.052 . . . . 0.0 113.841 -174.251 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 28.0 m -94.16 121.06 35.28 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.661 0.784 . . . . 0.0 111.463 -173.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 4.8 m -80.2 148.65 5.6 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.675 0 C-N-CA 124.62 1.168 . . . . 0.0 111.358 168.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 45.5 p -132.69 144.46 50.32 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 124.93 1.292 . . . . 0.0 111.193 174.843 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -67.31 152.17 52.59 Favored Glycine 0 CA--C 1.539 1.563 0 C-N-CA 124.419 1.009 . . . . 0.0 113.94 176.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 46.3 t -133.19 137.74 52.83 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.956 0 C-N-CA 125.937 1.695 . . . . 0.0 111.108 178.591 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 33.3 t80 -69.95 140.92 53.09 Favored 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 114.51 1.3 . . . . 0.0 114.51 -173.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 40.1 t0 -114.33 108.5 17.0 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 127.341 2.257 . . . . 0.0 110.469 170.858 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -66.23 -27.5 68.02 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 114.317 1.229 . . . . 0.0 114.317 -179.461 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -74.92 -50.76 15.73 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-N 118.994 0.815 . . . . 0.0 112.09 -176.79 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 25.3 t -77.52 -31.95 53.76 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 123.452 0.701 . . . . 0.0 111.704 174.255 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 81.92 29.53 38.07 Favored Glycine 0 CA--C 1.53 1.012 0 C-N-CA 124.011 0.815 . . . . 0.0 112.201 -173.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 80.0 mm-40 -129.61 -174.08 3.2 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 126.529 1.932 . . . . 0.0 110.156 -176.422 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 53.8 m95 -117.99 156.63 28.21 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.458 1.103 . . . . 0.0 110.986 178.815 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 17.7 m -137.62 140.36 41.57 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 C-N-CA 125.505 1.522 . . . . 0.0 112.816 -177.473 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 1.1 m0 -90.95 105.6 17.94 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 126.575 1.95 . . . . 0.0 108.682 173.697 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 30.8 mmmt -72.27 142.52 48.91 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 125.144 1.378 . . . . 0.0 111.239 -177.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 57.9 t30 51.2 39.45 23.7 Favored 'General case' 0 CA--C 1.553 1.078 0 C-N-CA 125.633 1.573 . . . . 0.0 113.496 -177.247 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 89.7 m -124.01 149.63 45.8 Favored 'General case' 0 N--CA 1.482 1.129 0 O-C-N 120.629 -1.295 . . . . 0.0 112.966 -170.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 10.4 tt -141.51 137.27 32.4 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.636 0 C-N-CA 127.326 2.25 . . . . 0.0 110.638 178.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 77.5 tt0 -107.19 137.18 45.74 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 125.295 1.438 . . . . 0.0 109.664 169.715 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 7.6 p -151.71 123.29 1.06 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 C-N-CA 124.789 1.236 . . . . 0.0 110.847 179.084 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 35.3 m120 49.09 41.31 19.21 Favored 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 125.914 1.685 . . . . 0.0 114.11 174.433 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 85.97 1.41 86.85 Favored Glycine 0 CA--C 1.536 1.378 0 N-CA-C 116.071 1.189 . . . . 0.0 116.071 179.48 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -114.42 153.09 30.51 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 125.662 1.585 . . . . 0.0 111.984 177.469 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 42.0 m-85 -112.35 145.04 40.78 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 125.237 1.415 . . . . 0.0 111.937 177.8 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 99.1 m-85 -152.41 164.84 36.72 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 125.161 1.384 . . . . 0.0 111.541 -176.795 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 596' ' ' HIS . . . . . . . . . . . . . 21.4 m80 -78.15 144.51 36.35 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 166.501 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 19.5 t -64.16 -44.99 90.41 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 118.419 0.554 . . . . 0.0 111.365 178.29 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 22.8 p -64.09 -34.98 79.28 Favored 'General case' 0 N--CA 1.479 1.004 0 N-CA-C 114.016 1.117 . . . . 0.0 114.016 175.358 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 599' ' ' CYS . . . . . . . . . . . . . 87.9 m -71.53 -54.74 9.53 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 123.84 0.856 . . . . 0.0 111.22 176.226 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 70.7 t80 -61.04 -34.99 75.73 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 123.587 0.755 . . . . 0.0 112.606 -178.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 82.7 t60 -55.7 -31.88 62.83 Favored 'General case' 0 CA--C 1.543 0.688 0 O-C-N 121.167 -0.958 . . . . 0.0 113.554 176.394 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -73.27 -25.2 60.59 Favored 'General case' 0 CA--C 1.548 0.888 0 O-C-N 121.203 -0.935 . . . . 0.0 113.387 174.532 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 44.0 p -106.64 0.35 24.32 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 125.384 1.474 . . . . 0.0 114.429 -175.439 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 604' ' ' SER . . . . . . . . . . . . . 49.6 m -65.04 88.35 0.07 Allowed 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 125.503 1.521 . . . . 0.0 113.695 -179.83 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 605' ' ' GLN . . . . . . . . . . . . . 91.2 mt-30 -64.81 118.27 8.74 Favored 'General case' 0 CA--C 1.54 0.594 0 O-C-N 120.978 -1.077 . . . . 0.0 110.609 171.137 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 606' ' ' ASN . . . . . . . . . . . . . 5.2 p30 -154.25 148.84 26.34 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.325 1.05 . . . . 0.0 112.142 -177.376 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 607' ' ' SER . . . . . . . . . . . . . 72.2 p -165.31 -42.96 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 125.307 1.443 . . . . 0.0 112.039 174.204 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 608' ' ' SER . . . . . . . . . . . . . 51.6 p . . . . . 0 C--O 1.253 1.284 0 C-N-CA 126.447 1.899 . . . . 0.0 113.824 173.581 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 533' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.577 0 N-CA-C 111.896 -0.481 . . . . 0.0 111.896 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . -68.71 150.2 50.35 Favored Glycine 0 CA--C 1.537 1.424 0 C-N-CA 123.814 0.721 . . . . 0.0 113.631 178.882 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 535' ' ' SER . . . . . . . . . . . . . 78.4 p -70.65 -24.13 62.65 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.574 1.149 . . . . 0.0 113.683 178.878 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 536' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -141.28 94.07 2.65 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 125.953 1.701 . . . . 0.0 108.877 173.872 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 537' ' ' PHE . . . . . . . . . . . . . 52.7 t80 -153.91 -178.06 6.82 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 125.58 1.552 . . . . 0.0 111.423 -169.37 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 36.9 m -56.27 160.43 3.01 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 125.631 1.572 . . . . 0.0 113.688 174.25 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 539' ' ' ASP . . . . . . . . . . . . . 66.9 m-20 -73.03 69.58 1.0 Allowed 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 125.887 1.675 . . . . 0.0 113.825 -174.232 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 540' ' ' ARG . . . . . . . . . . . . . 27.7 mmm180 -73.08 63.04 0.66 Allowed 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 126.576 1.95 . . . . 0.0 112.349 175.148 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 43.8 t -64.39 152.4 41.5 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 125.46 1.504 . . . . 0.0 112.77 177.455 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 542' ' ' ASN . . . . . . . . . . . . . 77.6 m-20 -57.57 -26.36 61.35 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 124.016 0.926 . . . . 0.0 112.427 170.471 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 47.4 tp10 -54.97 -38.09 67.34 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 125.01 1.324 . . . . 0.0 111.892 173.432 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 37.2 mt -73.4 -36.39 66.0 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 123.501 0.72 . . . . 0.0 112.256 179.018 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -71.15 -33.53 70.13 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 123.864 0.865 . . . . 0.0 113.052 -179.049 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 12.0 mm -67.09 -35.83 75.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 122.963 0.505 . . . . 0.0 110.736 171.255 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 95.6 mtt-85 -77.84 -25.88 49.04 Favored 'General case' 0 N--CA 1.48 1.049 0 O-C-N 121.027 -1.046 . . . . 0.0 113.399 178.381 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -69.59 -9.01 61.08 Favored Glycine 0 CA--C 1.537 1.417 0 C-N-CA 125.537 1.541 . . . . 0.0 115.087 176.026 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -63.04 149.82 44.07 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-N 118.513 1.156 . . . . 0.0 111.714 170.744 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 45.6 p90 -156.44 166.61 32.93 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.205 1.002 . . . . 0.0 112.373 176.039 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 12.0 m -129.7 140.32 49.35 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 C-N-CA 126.299 1.84 . . . . 0.0 109.258 169.448 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 48.4 t -71.45 128.58 34.72 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.106 0 O-C-N 121.16 -0.963 . . . . 0.0 110.006 -177.225 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 4.0 t -79.72 126.37 80.51 Favored Pre-proline 0 CA--C 1.538 0.498 0 C-N-CA 123.78 0.832 . . . . 0.0 109.001 171.169 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -66.82 145.15 73.9 Favored 'Trans proline' 0 CA--C 1.538 0.698 0 C-N-CA 122.734 2.289 . . . . 0.0 112.248 -177.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 17.1 pt-20 -63.14 -17.13 62.01 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 113.49 0.922 . . . . 0.0 113.49 175.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 10.7 m -66.08 -30.86 71.45 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 125.436 1.494 . . . . 0.0 112.002 171.729 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 28.7 t -81.01 130.84 35.2 Favored 'General case' 0 N--CA 1.472 0.643 0 O-C-N 121.632 -0.668 . . . . 0.0 111.684 174.062 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 2.6 pm0 -101.8 -25.8 13.69 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.692 1.597 . . . . 0.0 112.203 169.08 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 87.3 m-20 -77.41 -38.08 50.52 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 124.456 1.103 . . . . 0.0 112.924 179.781 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 8.7 mtt 51.46 36.01 15.69 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.694 1.597 . . . . 0.0 115.131 175.284 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -131.74 146.55 52.22 Favored 'General case' 0 CA--C 1.54 0.558 0 N-CA-C 114.057 1.132 . . . . 0.0 114.057 -173.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 2.8 t80 -153.98 179.66 8.7 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 125.749 1.62 . . . . 0.0 110.38 173.57 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 22.9 ttmm -135.05 138.16 43.62 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 124.434 1.094 . . . . 0.0 113.038 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 26.4 t -71.62 116.75 50.94 Favored Pre-proline 0 CA--C 1.539 0.544 0 C-N-CA 126.301 1.84 . . . . 0.0 110.198 170.271 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo -72.65 -17.68 26.04 Favored 'Trans proline' 0 CA--C 1.543 0.951 0 C-N-CA 122.859 2.373 . . . . 0.0 113.581 176.3 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 90.7 mt -73.02 -55.35 13.09 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 CA-C-N 119.803 1.183 . . . . 0.0 110.953 -178.547 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 14.9 p -103.35 2.76 34.44 Favored 'General case' 0 CA--C 1.553 1.062 0 C-N-CA 124.566 1.146 . . . . 0.0 113.494 -179.242 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 568' ' ' LYS . . . . . . . . . . . . 0.335 64.1 pttt 56.0 42.92 28.01 Favored 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 127.083 2.153 . . . . 0.0 113.608 -177.63 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 69.8 mm-40 -119.6 137.81 53.63 Favored 'General case' 0 N--CA 1.483 1.207 0 N-CA-C 114.803 1.409 . . . . 0.0 114.803 -174.666 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 49.9 m -74.37 140.55 44.86 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 124.679 1.192 . . . . 0.0 112.992 -178.214 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -114.84 145.51 20.5 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.617 0 C-N-CA 126.576 1.95 . . . . 0.0 110.86 168.948 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 44.6 p -133.31 141.53 48.01 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.601 1.16 . . . . 0.0 111.794 178.752 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -70.6 147.32 43.47 Favored Glycine 0 CA--C 1.534 1.236 0 C-N-CA 124.709 1.147 . . . . 0.0 113.615 -179.637 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 71.8 t -130.03 141.98 44.98 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 C-N-CA 125.318 1.447 . . . . 0.0 111.139 -179.737 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 62.0 t80 -65.41 131.33 46.16 Favored 'General case' 0 CA--C 1.544 0.742 0 CA-C-O 121.828 0.823 . . . . 0.0 112.725 -175.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 49.9 t0 -96.03 99.39 11.15 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 126.723 2.009 . . . . 0.0 111.391 174.061 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 69.0 mt-10 -66.34 -21.79 66.25 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 124.746 1.219 . . . . 0.0 113.958 179.776 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 36.7 tp10 -72.96 -34.66 66.64 Favored 'General case' 0 CA--C 1.542 0.645 0 O-C-N 120.499 -1.376 . . . . 0.0 113.103 -176.54 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 63.7 m -124.13 -13.13 7.33 Favored 'General case' 0 N--CA 1.474 0.749 0 N-CA-C 114.853 1.427 . . . . 0.0 114.853 -178.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 84.08 33.14 21.57 Favored Glycine 0 CA--C 1.531 1.055 0 C-N-CA 124.309 0.957 . . . . 0.0 113.209 176.209 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -121.83 -162.63 1.0 Allowed 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 125.14 1.376 . . . . 0.0 109.769 -178.488 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 62.8 m95 -129.18 155.08 46.09 Favored 'General case' 0 CA--C 1.533 0.302 0 O-C-N 121.116 -0.99 . . . . 0.0 111.465 175.431 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 16.2 m -139.37 134.03 39.54 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 C-N-CA 124.788 1.235 . . . . 0.0 112.933 -173.86 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 1.0 OUTLIER -86.46 96.91 10.2 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 126.618 1.967 . . . . 0.0 108.331 169.748 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 67.3 mttm -74.34 149.75 40.44 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 124.674 1.19 . . . . 0.0 111.841 -179.838 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 64.79 0.62 1.2 Allowed 'General case' 0 CA--C 1.56 1.331 0 C-N-CA 126.805 2.042 . . . . 0.0 113.895 -172.269 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 54.0 m -94.91 149.05 21.66 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 125.622 1.569 . . . . 0.0 113.658 -171.186 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 14.4 tt -136.65 146.39 28.72 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.63 0 C-N-CA 127.834 2.454 . . . . 0.0 110.262 172.863 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 73.3 tt0 -108.3 126.87 53.33 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 124.632 1.173 . . . . 0.0 110.908 170.74 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 7.7 p -154.12 135.95 5.92 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 C-N-CA 124.951 1.3 . . . . 0.0 111.199 -177.441 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 71.9 m-20 52.54 38.28 25.27 Favored 'General case' 0 CA--C 1.552 1.057 0 C-N-CA 125.177 1.391 . . . . 0.0 113.666 -179.43 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 76.54 11.04 85.54 Favored Glycine 0 CA--C 1.535 1.305 0 C-N-CA 125.33 1.443 . . . . 0.0 115.62 178.438 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 56.8 mtmt -133.01 155.13 49.75 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 125.653 1.581 . . . . 0.0 111.907 -178.312 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 69.9 m-85 -92.48 147.2 23.09 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 124.271 1.028 . . . . 0.0 112.321 175.234 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 90.1 m-85 -152.21 171.12 18.43 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 126.554 1.942 . . . . 0.0 110.241 -174.432 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 596' ' ' HIS . . . . . . . . . . . . . 17.4 m80 -89.8 140.56 29.47 Favored 'General case' 0 N--CA 1.471 0.581 0 O-C-N 121.31 -0.869 . . . . 0.0 109.273 167.54 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 67.6 m -60.14 -41.72 93.31 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 123.391 0.676 . . . . 0.0 112.113 176.724 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 5.6 p -64.81 -42.73 94.77 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 124.977 1.311 . . . . 0.0 112.575 175.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 599' ' ' CYS . . . . . . . . . . . . . 90.8 m -65.57 -51.65 58.23 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 124.283 1.033 . . . . 0.0 111.108 177.147 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 83.7 t80 -57.84 -35.1 70.44 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 123.718 0.807 . . . . 0.0 112.608 178.064 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 1.7 m-70 -64.94 -21.63 66.86 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 114.352 1.241 . . . . 0.0 114.352 174.465 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 74.7 mt-10 -90.52 -34.15 15.66 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 119.369 0.986 . . . . 0.0 113.275 171.272 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 69.0 p -92.73 5.49 50.92 Favored 'General case' 0 N--CA 1.482 1.127 0 N-CA-C 114.542 1.312 . . . . 0.0 114.542 -175.057 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 604' ' ' SER . . . . . . . . . . . . . 98.0 p -62.85 -24.73 67.93 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 124.674 1.19 . . . . 0.0 113.97 -177.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 605' ' ' GLN . . . . . . . . . . . . . 77.9 mm-40 -98.87 134.32 41.9 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 125.257 1.423 . . . . 0.0 111.767 178.454 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 606' ' ' ASN . . . . . . . . . . . . . 52.3 t30 -76.33 162.66 27.72 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 123.724 0.81 . . . . 0.0 112.666 176.276 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 607' ' ' SER . . . . . . . . . . . . . 81.5 p -73.14 -12.89 61.05 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 114.709 1.374 . . . . 0.0 114.709 177.358 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 608' ' ' SER . . . . . . . . . . . . . 51.4 p . . . . . 0 C--O 1.254 1.306 0 C-N-CA 126.117 1.767 . . . . 0.0 113.993 178.254 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 533' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.508 0 N-CA-C 111.186 -0.766 . . . . 0.0 111.186 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . -77.03 -170.69 33.6 Favored Glycine 0 CA--C 1.538 1.476 0 C-N-CA 124.601 1.096 . . . . 0.0 114.416 175.538 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 535' ' ' SER . . . . . . . . . . . . . 43.3 t -62.78 140.06 58.73 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 124.055 0.942 . . . . 0.0 112.569 177.425 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 536' ' ' GLU . . . . . . . . . . . . . 4.0 pm0 -75.69 -18.42 59.62 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.261 1.025 . . . . 0.0 113.68 176.016 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 537' ' ' PHE . . . . . . . . . . . . . 47.7 t80 -157.73 -61.75 0.09 Allowed 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.993 0.917 . . . . 0.0 112.92 -178.869 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 59.6 p -157.81 172.13 19.05 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 124.747 1.219 . . . . 0.0 112.651 179.149 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 539' ' ' ASP . . . . . . . . . . . . . 41.0 p-10 -76.75 1.23 17.81 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 125.607 1.563 . . . . 0.0 114.731 177.074 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 540' ' ' ARG . . . . . . . . . . . . . 10.9 mpt_? -68.38 145.41 54.18 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 124.186 0.994 . . . . 0.0 112.729 179.1 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 89.4 p -148.63 9.92 0.82 Allowed 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 126.128 1.771 . . . . 0.0 112.46 173.791 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 542' ' ' ASN . . . . . . . . . . . . . 15.2 p-10 -115.39 -9.93 12.07 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 128.27 2.628 . . . . 0.0 113.201 -169.568 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 3.1 pm0 -62.05 -30.71 71.17 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 113.922 1.082 . . . . 0.0 113.922 -171.694 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 63.3 tp -69.66 -39.56 76.98 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.546 0.738 . . . . 0.0 111.793 174.517 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 58.1 mt-10 -83.22 -39.39 20.99 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 124.069 0.948 . . . . 0.0 113.279 -171.869 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 30.1 mm -65.14 -35.69 76.01 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.548 0 C-N-CA 123.359 0.664 . . . . 0.0 110.519 175.558 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -74.31 -22.41 59.28 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 124.216 1.007 . . . . 0.0 113.219 176.416 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -72.61 -13.58 77.9 Favored Glycine 0 CA--C 1.537 1.416 0 C-N-CA 124.709 1.147 . . . . 0.0 115.085 174.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -69.08 143.05 54.33 Favored 'General case' 0 N--CA 1.476 0.826 0 CA-C-N 118.272 1.036 . . . . 0.0 111.909 176.882 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 54.8 p90 -151.74 164.5 36.86 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 124.545 1.138 . . . . 0.0 112.634 173.718 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 10.6 m -130.48 139.99 49.94 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 C-N-CA 126.491 1.917 . . . . 0.0 109.07 169.613 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 9.2 p -72.29 136.95 24.54 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.048 0 O-C-N 120.871 -1.143 . . . . 0.0 111.151 -175.781 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 11.9 t -84.06 120.06 74.24 Favored Pre-proline 0 N--CA 1.469 0.519 0 C-N-CA 124.122 0.969 . . . . 0.0 108.534 171.264 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 90.6 Cg_endo -73.56 156.76 49.44 Favored 'Trans proline' 0 CA--C 1.539 0.745 0 C-N-CA 122.724 2.283 . . . . 0.0 112.278 177.782 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -61.26 -24.17 66.19 Favored 'General case' 0 N--CA 1.482 1.168 0 O-C-N 121.473 -0.767 . . . . 0.0 112.656 175.069 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 67.8 p -74.08 -19.91 60.45 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 125.433 1.493 . . . . 0.0 114.136 176.181 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 4.1 m -75.54 95.39 3.31 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 119.073 0.851 . . . . 0.0 110.4 172.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 29.0 mt-30 -58.0 -43.17 86.46 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 125.457 1.503 . . . . 0.0 114.022 -169.846 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 63.6 m-20 -94.99 -12.04 27.4 Favored 'General case' 0 CA--C 1.545 0.786 0 N-CA-C 114.185 1.18 . . . . 0.0 114.185 -176.412 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 7.8 mtt 51.4 31.19 6.95 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 126.135 1.774 . . . . 0.0 113.787 -170.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -128.08 148.78 50.58 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.294 1.437 . . . . 0.0 112.256 -178.076 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -150.99 171.84 16.65 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 125.256 1.422 . . . . 0.0 109.761 176.186 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 563' ' ' LYS . . . . . . . . . . . . 0.292 0.0 OUTLIER -117.84 156.84 27.68 Favored 'General case' 0 N--CA 1.479 0.979 0 N-CA-C 114.715 1.376 . . . . 0.0 114.715 178.795 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 23.9 t -98.3 109.09 50.9 Favored Pre-proline 0 CA--C 1.539 0.519 0 C-N-CA 127.897 2.479 . . . . 0.0 109.999 169.803 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -62.33 -19.63 67.73 Favored 'Trans proline' 0 C--N 1.352 0.724 0 C-N-CA 123.148 2.565 . . . . 0.0 115.206 174.503 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 90.1 mt -73.78 -61.51 1.67 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.908 0 CA-C-N 119.455 1.025 . . . . 0.0 110.74 -178.756 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 15.7 p -96.19 -0.39 50.02 Favored 'General case' 0 CA--C 1.548 0.888 0 N-CA-C 114.126 1.158 . . . . 0.0 114.126 -177.335 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 568' ' ' LYS . . . . . . . . . . . . . 47.0 mmtm 58.59 46.14 15.14 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 125.904 1.682 . . . . 0.0 112.053 -176.684 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 53.2 mm-40 -117.8 161.12 20.24 Favored 'General case' 0 N--CA 1.484 1.249 0 N-CA-C 113.783 1.031 . . . . 0.0 113.783 -177.057 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 58.4 m -102.82 127.58 49.94 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 124.012 0.925 . . . . 0.0 112.442 -179.134 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 3.1 m -91.46 149.29 4.14 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 C-N-CA 124.651 1.18 . . . . 0.0 110.556 167.901 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 43.8 p -132.45 142.06 49.09 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 125.111 1.364 . . . . 0.0 110.585 174.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -67.25 152.49 52.73 Favored Glycine 0 CA--C 1.528 0.891 0 C-N-CA 124.092 0.853 . . . . 0.0 113.489 179.195 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 57.4 t -133.65 133.1 57.23 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.858 0 C-N-CA 125.253 1.421 . . . . 0.0 111.629 176.822 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 44.8 t80 -70.12 128.18 35.39 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 114.052 1.13 . . . . 0.0 114.052 -173.051 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 13.4 t0 -98.02 114.05 26.09 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 125.365 1.466 . . . . 0.0 109.02 168.409 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 9.7 mp0 -72.83 -27.24 61.83 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 114.242 1.201 . . . . 0.0 114.242 -173.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -83.26 -44.38 15.02 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 123.904 0.881 . . . . 0.0 112.058 179.869 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 59.8 m -71.85 -30.22 65.22 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.21 0.604 . . . . 0.0 112.249 171.884 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 77.4 26.37 61.56 Favored Glycine 0 CA--C 1.534 1.227 0 C-N-CA 124.797 1.189 . . . . 0.0 112.978 -177.905 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 55.0 mt-10 -142.43 150.94 41.26 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 125.598 1.559 . . . . 0.0 110.434 -171.49 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 43.3 m95 -84.67 151.78 24.22 Favored 'General case' 0 CA--C 1.543 0.677 0 O-C-N 121.204 -0.935 . . . . 0.0 111.23 179.629 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 17.3 m -134.39 139.35 48.15 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.31 0 C-N-CA 125.227 1.411 . . . . 0.0 112.792 -176.482 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 2.6 m0 -89.64 100.8 13.53 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 126.399 1.88 . . . . 0.0 107.855 171.27 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 53.2 mtmt -78.76 157.96 28.37 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 124.395 1.078 . . . . 0.0 112.024 179.809 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 9.1 t30 54.58 30.7 13.64 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 125.265 1.426 . . . . 0.0 113.047 -174.227 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 86.1 m -122.52 148.12 45.55 Favored 'General case' 0 N--CA 1.48 1.036 0 O-C-N 121.0 -1.063 . . . . 0.0 112.15 -169.774 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 15.6 tt -138.25 142.35 35.61 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 C-N-CA 127.313 2.245 . . . . 0.0 110.973 178.664 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 77.8 tt0 -102.96 127.27 50.25 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.457 1.103 . . . . 0.0 110.224 169.388 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 7.6 p -152.67 133.24 4.28 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 C-N-CA 125.113 1.365 . . . . 0.0 110.819 -178.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 74.9 m-20 53.96 41.71 31.93 Favored 'General case' 0 CA--C 1.551 0.986 0 C-N-CA 124.801 1.24 . . . . 0.0 113.104 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 73.7 11.26 80.61 Favored Glycine 0 CA--C 1.536 1.396 0 C-N-CA 124.813 1.197 . . . . 0.0 115.551 179.141 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 36.3 mtmm -134.96 156.13 49.55 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 126.341 1.857 . . . . 0.0 111.849 -173.418 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 75.9 m-85 -100.03 146.13 27.1 Favored 'General case' 0 N--CA 1.464 0.25 0 C-N-CA 124.364 1.066 . . . . 0.0 113.282 179.412 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 86.5 m-85 -151.76 165.9 33.0 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 126.592 1.957 . . . . 0.0 110.366 -173.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 596' ' ' HIS . . . . . . . . . . . . . 20.7 m80 -81.09 142.97 32.78 Favored 'General case' 0 N--CA 1.468 0.44 0 O-C-N 121.381 -0.824 . . . . 0.0 109.491 168.77 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 66.9 p -60.88 -44.79 96.59 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 123.919 0.888 . . . . 0.0 111.681 176.942 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 18.7 p -63.99 -44.7 91.89 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 125.023 1.329 . . . . 0.0 112.93 175.322 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 599' ' ' CYS . . . . . . . . . . . . . 97.5 m -60.97 -45.47 94.63 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.587 1.155 . . . . 0.0 111.792 178.605 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 84.2 t80 -72.95 -32.17 65.07 Favored 'General case' 0 CA--C 1.546 0.804 0 N-CA-C 113.382 0.882 . . . . 0.0 113.382 177.556 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 57.4 t-80 -75.16 -81.67 0.07 Allowed 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 114.706 1.373 . . . . 0.0 114.706 -174.178 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -95.93 -6.96 37.89 Favored 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 113.616 0.969 . . . . 0.0 113.616 -174.253 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 1.5 m -91.81 -47.75 7.17 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.585 1.154 . . . . 0.0 111.996 -177.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 604' ' ' SER . . . . . . . . . . . . . 22.6 t -70.41 152.51 43.99 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 123.512 0.725 . . . . 0.0 111.233 171.736 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 605' ' ' GLN . . . . . . . . . . . . . 60.6 tt0 -64.8 123.1 18.5 Favored 'General case' 0 CA--C 1.541 0.621 0 O-C-N 121.409 -0.807 . . . . 0.0 110.673 177.472 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 606' ' ' ASN . . . . . . . . . . . . . 59.0 t30 -69.69 130.71 43.11 Favored 'General case' 0 CA--C 1.545 0.767 0 N-CA-C 113.242 0.83 . . . . 0.0 113.242 -169.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 607' ' ' SER . . . . . . . . . . . . . 42.0 m -78.66 163.98 25.0 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.997 1.319 . . . . 0.0 112.707 173.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 608' ' ' SER . . . . . . . . . . . . . 53.4 p . . . . . 0 C--O 1.252 1.234 0 C-N-CA 125.125 1.37 . . . . 0.0 113.309 170.821 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 533' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.545 0 N-CA-C 111.322 -0.711 . . . . 0.0 111.322 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . -82.4 -153.1 11.61 Favored Glycine 0 CA--C 1.537 1.453 0 C-N-CA 124.587 1.089 . . . . 0.0 113.586 176.106 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 535' ' ' SER . . . . . . . . . . . . . 77.8 p -67.37 -15.6 63.77 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 124.502 1.121 . . . . 0.0 113.488 172.212 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 536' ' ' GLU . . . . . . . . . . . . . 45.4 tt0 -138.85 125.13 20.29 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 126.565 1.946 . . . . 0.0 109.958 173.717 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 537' ' ' PHE . . . . . . . . . . . . . 38.6 p90 -158.45 172.53 18.16 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.188 1.395 . . . . 0.0 111.543 -178.761 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 16.8 t -149.3 159.76 43.99 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 125.164 1.385 . . . . 0.0 111.758 179.489 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 539' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -147.32 171.28 15.67 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 125.478 1.511 . . . . 0.0 112.045 -177.689 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 540' ' ' ARG . . . . . . . . . . . . . 77.3 mmt-85 -121.29 18.94 11.47 Favored 'General case' 0 N--CA 1.479 1.016 0 N-CA-C 114.542 1.312 . . . . 0.0 114.542 -171.088 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 44.2 t -62.2 119.39 8.91 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 121.635 -0.666 . . . . 0.0 110.94 175.019 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 542' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -78.13 -19.8 53.37 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 123.386 0.674 . . . . 0.0 111.769 176.648 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -63.18 -28.96 70.41 Favored 'General case' 0 CA--C 1.54 0.558 0 N-CA-C 113.465 0.913 . . . . 0.0 113.465 -170.615 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -65.03 -40.89 95.5 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.003 0.921 . . . . 0.0 111.488 174.197 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 75.7 mm-40 -76.07 -30.55 58.4 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.76 0.824 . . . . 0.0 112.661 178.101 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 11.2 mm -66.34 -40.97 88.08 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.599 0 C-N-CA 123.991 0.916 . . . . 0.0 110.297 169.083 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 79.7 ttt180 -65.94 -28.92 69.28 Favored 'General case' 0 N--CA 1.478 0.927 0 O-C-N 121.125 -0.984 . . . . 0.0 112.173 -179.202 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -71.96 -7.55 66.65 Favored Glycine 0 CA--C 1.542 1.734 0 C-N-CA 124.706 1.146 . . . . 0.0 115.428 175.061 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 41.8 mmtm -70.3 144.66 51.67 Favored 'General case' 0 N--CA 1.479 0.996 0 CA-C-N 119.771 1.786 . . . . 0.0 111.227 177.858 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 40.2 p90 -149.29 166.47 28.86 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 113.937 1.088 . . . . 0.0 113.937 178.198 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 4.8 m -136.74 138.84 45.8 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.841 0 C-N-CA 126.801 2.04 . . . . 0.0 109.73 174.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 44.0 t -70.29 133.98 30.88 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 O-C-N 121.084 -1.01 . . . . 0.0 110.998 -177.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 3.1 t -91.88 124.31 60.63 Favored Pre-proline 0 N--CA 1.471 0.591 0 C-N-CA 124.273 1.029 . . . . 0.0 111.639 178.198 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 62.1 Cg_endo -80.48 152.46 20.32 Favored 'Trans proline' 0 CA--C 1.538 0.714 0 C-N-CA 123.274 2.649 . . . . 0.0 111.638 169.893 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -66.77 -18.32 65.31 Favored 'General case' 0 CA--C 1.548 0.88 0 O-C-N 120.401 -1.437 . . . . 0.0 113.103 175.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -71.73 -22.65 61.6 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 124.877 1.271 . . . . 0.0 113.44 173.204 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 9.6 m -73.51 121.63 20.9 Favored 'General case' 0 N--CA 1.473 0.702 0 O-C-N 121.497 -0.752 . . . . 0.0 110.328 170.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 55.2 tp60 -53.41 116.09 2.26 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 125.077 1.351 . . . . 0.0 112.484 -168.514 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 53.31 20.95 2.1 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 126.559 1.944 . . . . 0.0 114.822 177.789 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 28.6 mtt 53.47 33.08 15.27 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 125.522 1.529 . . . . 0.0 113.443 -168.834 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -126.95 134.65 50.36 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 125.031 1.332 . . . . 0.0 112.544 -177.053 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 41.6 t80 -148.21 161.33 41.69 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 124.861 1.264 . . . . 0.0 110.041 174.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 3.5 ttmp? -112.67 131.26 55.73 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 123.827 0.851 . . . . 0.0 113.001 -171.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 22.6 t -68.11 111.77 8.8 Favored Pre-proline 0 CA--C 1.541 0.633 0 C-N-CA 126.064 1.745 . . . . 0.0 109.479 168.644 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -69.83 -17.34 37.32 Favored 'Trans proline' 0 CA--C 1.54 0.815 0 C-N-CA 122.515 2.143 . . . . 0.0 113.349 177.691 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 86.8 mt -70.28 -51.54 37.63 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.672 0 C-N-CA 124.593 1.157 . . . . 0.0 110.898 -177.706 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 14.6 p -110.75 -0.86 16.89 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 124.729 1.212 . . . . 0.0 114.071 -178.877 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 568' ' ' LYS . . . . . . . . . . . . . 34.1 mmtp 60.64 45.86 9.88 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 126.604 1.962 . . . . 0.0 113.352 -177.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 74.7 mt-10 -120.79 138.67 53.91 Favored 'General case' 0 N--CA 1.481 1.078 0 N-CA-C 113.746 1.017 . . . . 0.0 113.746 -175.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 97.1 m -83.77 121.48 27.36 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.256 0.622 . . . . 0.0 112.181 -179.234 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 1.7 m -88.11 143.65 10.82 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 C-N-CA 125.22 1.408 . . . . 0.0 110.364 168.172 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 69.1 p -124.62 142.77 51.13 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 124.971 1.309 . . . . 0.0 111.629 -179.187 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -74.97 145.55 33.8 Favored Glycine 0 CA--C 1.53 0.988 0 C-N-CA 124.302 0.953 . . . . 0.0 113.372 179.065 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 61.6 t -135.32 141.6 42.11 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.875 0 C-N-CA 125.599 1.56 . . . . 0.0 111.554 -177.336 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 62.1 t80 -70.52 127.39 32.55 Favored 'General case' 0 CA--C 1.542 0.64 0 O-C-N 121.277 -0.889 . . . . 0.0 112.976 -176.697 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 65.1 t0 -94.12 104.21 16.24 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 127.072 2.149 . . . . 0.0 109.892 170.015 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -66.89 -26.97 67.14 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.072 1.349 . . . . 0.0 114.45 -177.624 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 31.8 tp10 -78.66 -44.31 24.04 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 123.609 0.763 . . . . 0.0 111.713 -178.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 22.8 t -81.57 -35.32 30.37 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 124.903 1.281 . . . . 0.0 112.276 177.219 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 84.17 32.81 22.18 Favored Glycine 0 CA--C 1.53 1.031 0 C-N-CA 124.513 1.054 . . . . 0.0 113.468 -172.736 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 81.8 mm-40 -130.16 178.54 6.48 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.479 1.512 . . . . 0.0 110.705 -175.537 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 68.6 m95 -111.25 145.4 38.82 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 121.015 -1.053 . . . . 0.0 110.251 171.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 13.8 m -137.72 138.04 44.68 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.892 0 C-N-CA 124.985 1.314 . . . . 0.0 113.227 -172.057 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 0.8 OUTLIER -87.26 100.95 13.07 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 126.327 1.851 . . . . 0.0 107.228 169.952 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 56.7 mtmt -73.56 157.03 37.46 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 124.184 0.993 . . . . 0.0 111.253 177.093 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 55.2 33.4 20.48 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 125.307 1.443 . . . . 0.0 112.392 -176.407 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 55.2 m -130.36 147.78 52.1 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 124.71 1.204 . . . . 0.0 112.239 -169.432 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 14.7 tt -136.41 144.16 33.61 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.718 0 C-N-CA 126.978 2.111 . . . . 0.0 111.096 178.543 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -105.89 135.79 46.7 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 125.243 1.417 . . . . 0.0 110.157 168.722 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 7.5 p -147.66 123.51 2.64 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.619 0 C-N-CA 124.289 1.036 . . . . 0.0 111.006 173.88 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 69.9 m-20 51.08 36.58 15.78 Favored 'General case' 0 CA--C 1.551 1.003 0 C-N-CA 125.472 1.509 . . . . 0.0 114.245 175.402 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 89.15 -9.19 77.82 Favored Glycine 0 CA--C 1.536 1.405 0 C-N-CA 125.32 1.438 . . . . 0.0 115.633 -179.221 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 63.4 mttp -95.87 153.77 17.58 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 125.578 1.551 . . . . 0.0 111.78 176.329 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 69.1 m-85 -113.38 142.75 45.5 Favored 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 125.0 1.32 . . . . 0.0 112.259 174.485 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 16.3 m-85 -149.18 159.01 44.63 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 126.307 1.843 . . . . 0.0 110.6 -173.569 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 596' ' ' HIS . . . . . . . . . . . . . 11.8 m80 -71.31 139.13 49.81 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 106.539 -1.652 . . . . 0.0 106.539 165.555 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 72.8 p -59.3 -43.0 92.65 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 122.995 0.518 . . . . 0.0 111.935 178.603 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 14.1 p -71.59 -33.41 69.01 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 125.362 1.465 . . . . 0.0 113.693 178.144 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 599' ' ' CYS . . . . . . . . . . . . . 99.3 m -66.68 -52.46 44.57 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.657 0.783 . . . . 0.0 111.021 172.495 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 66.1 t80 -57.53 -40.67 79.32 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 123.183 0.593 . . . . 0.0 111.955 176.73 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 69.8 t60 -56.36 -46.84 79.82 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.837 1.255 . . . . 0.0 113.872 175.384 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -77.76 -23.75 49.15 Favored 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 114.044 1.127 . . . . 0.0 114.044 174.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 68.4 m -77.38 -29.21 53.14 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 124.939 1.296 . . . . 0.0 112.714 179.227 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 604' ' ' SER . . . . . . . . . . . . . 33.4 t -56.48 112.1 1.17 Allowed 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.817 1.247 . . . . 0.0 112.809 -174.664 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 605' ' ' GLN . . . . . . . . . . . . . 43.1 tp60 -160.3 -39.39 0.05 Allowed 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 126.475 1.91 . . . . 0.0 111.571 -176.347 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 606' ' ' ASN . . . . . . . . . . . . . 14.8 p-10 -72.13 -9.07 57.92 Favored 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 125.995 1.718 . . . . 0.0 114.404 174.62 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 607' ' ' SER . . . . . . . . . . . . . 20.4 m -62.97 141.98 58.53 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 125.541 1.536 . . . . 0.0 113.29 -175.649 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 608' ' ' SER . . . . . . . . . . . . . 39.2 m . . . . . 0 C--O 1.253 1.269 0 C-N-CA 125.578 1.551 . . . . 0.0 114.05 179.066 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 533' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.71 0 N-CA-C 111.866 -0.494 . . . . 0.0 111.866 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 72.35 22.69 78.79 Favored Glycine 0 CA--C 1.538 1.489 0 O-C-N 121.76 -0.847 . . . . 0.0 115.197 177.385 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 535' ' ' SER . . . . . . . . . . . . . 71.4 p -68.68 -15.25 63.46 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 124.949 1.299 . . . . 0.0 114.438 -178.474 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 536' ' ' GLU . . . . . . . . . . . . . 11.9 tp10 -141.5 110.24 6.11 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 125.655 1.582 . . . . 0.0 108.928 171.635 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 537' ' ' PHE . . . . . . . . . . . . . 42.6 p90 -73.66 -20.69 60.49 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 115.294 1.59 . . . . 0.0 115.294 -169.238 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 69.1 m -110.54 -4.2 15.6 Favored 'General case' 0 N--CA 1.48 1.058 0 N-CA-C 114.667 1.358 . . . . 0.0 114.667 179.4 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 539' ' ' ASP . . . . . . . . . . . . . 12.0 t0 56.82 -165.75 0.14 Allowed 'General case' 0 CA--C 1.559 1.325 0 C-N-CA 124.65 1.18 . . . . 0.0 111.342 -168.245 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 540' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.81 -16.84 63.62 Favored 'General case' 0 N--CA 1.484 1.238 0 O-C-N 119.931 -1.731 . . . . 0.0 114.183 174.782 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 20.3 m -65.62 130.84 44.71 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 125.535 1.534 . . . . 0.0 111.793 -179.035 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 542' ' ' ASN . . . . . . . . . . . . . 45.9 m-80 -140.64 120.28 13.33 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 125.212 1.405 . . . . 0.0 110.639 -179.655 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 16.8 pt-20 -152.3 -29.61 0.16 Allowed 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 124.475 1.11 . . . . 0.0 113.927 179.596 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 86.7 mt -67.64 -30.88 70.56 Favored 'General case' 0 N--CA 1.472 0.671 0 O-C-N 121.48 -0.762 . . . . 0.0 112.468 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 18.0 tp10 -64.56 -30.49 71.51 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.524 1.13 . . . . 0.0 112.49 176.589 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 18.5 mm -62.78 -34.77 67.59 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 124.952 1.301 . . . . 0.0 111.454 -178.567 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 45.0 ttt180 -61.34 -21.66 64.21 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.518 1.127 . . . . 0.0 112.879 179.442 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -71.79 -11.67 73.75 Favored Glycine 0 CA--C 1.539 1.569 0 C-N-CA 124.643 1.116 . . . . 0.0 115.251 176.03 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -69.76 146.32 51.55 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-N 119.201 1.501 . . . . 0.0 112.18 173.417 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 47.6 p90 -156.5 166.52 33.18 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 124.955 1.302 . . . . 0.0 111.772 171.59 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 2.5 m -128.93 133.5 66.0 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 C-N-CA 124.618 1.167 . . . . 0.0 109.745 170.479 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 53.3 t -68.23 132.41 32.78 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 O-C-N 121.26 -0.9 . . . . 0.0 110.113 -179.796 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 22.4 t -78.97 119.08 75.94 Favored Pre-proline 0 N--CA 1.472 0.651 0 CA-C-O 118.483 -0.77 . . . . 0.0 110.588 -179.239 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 65.3 Cg_endo -78.82 156.24 27.24 Favored 'Trans proline' 0 CA--C 1.537 0.643 0 C-N-CA 123.126 2.551 . . . . 0.0 112.15 176.84 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -67.47 -17.81 64.83 Favored 'General case' 0 N--CA 1.474 0.738 0 O-C-N 121.486 -0.759 . . . . 0.0 112.884 176.885 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 66.8 p -74.06 -22.99 59.31 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 125.02 1.328 . . . . 0.0 113.493 173.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 24.7 m -80.2 112.09 17.18 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 123.997 0.919 . . . . 0.0 111.683 175.258 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -62.08 136.22 57.85 Favored 'General case' 0 CA--C 1.546 0.824 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 -173.667 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 33.8 m-20 53.92 15.32 0.83 Allowed 'General case' 0 CA--C 1.553 1.073 0 C-N-CA 126.733 2.013 . . . . 0.0 115.418 176.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 18.9 mtt 51.35 31.93 7.78 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 125.672 1.589 . . . . 0.0 114.659 -171.494 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -123.95 142.67 50.95 Favored 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 113.851 1.056 . . . . 0.0 113.851 -174.526 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 6.5 t80 -153.91 -179.97 8.35 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 125.919 1.688 . . . . 0.0 109.963 173.378 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 18.1 ttmm -130.56 152.91 49.42 Favored 'General case' 0 N--CA 1.48 1.032 0 O-C-N 120.628 -1.295 . . . . 0.0 113.385 -175.273 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 19.2 t -95.9 107.0 31.5 Favored Pre-proline 0 CA--C 1.543 0.71 0 C-N-CA 127.865 2.466 . . . . 0.0 110.307 170.865 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_exo -62.38 -20.45 70.37 Favored 'Trans proline' 0 CA--C 1.546 1.086 0 C-N-CA 122.268 1.979 . . . . 0.0 115.736 174.71 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 88.7 mt -69.38 -52.26 34.51 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 C-N-CA 124.266 1.026 . . . . 0.0 111.35 -177.205 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 14.9 p -108.62 -0.71 20.06 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 124.328 1.051 . . . . 0.0 113.717 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 568' ' ' LYS . . . . . . . . . . . . . 95.1 mttt 59.82 44.43 13.88 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 126.966 2.106 . . . . 0.0 113.151 -177.571 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 64.8 mt-10 -112.0 138.93 47.97 Favored 'General case' 0 N--CA 1.479 0.995 0 N-CA-C 113.488 0.922 . . . . 0.0 113.488 -177.697 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 57.7 m -85.71 121.24 28.1 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 123.216 0.606 . . . . 0.0 111.037 177.778 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 3.8 m -88.4 144.15 9.76 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 C-N-CA 125.442 1.497 . . . . 0.0 110.502 170.414 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 74.6 p -128.94 144.81 51.29 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.976 1.311 . . . . 0.0 110.799 174.274 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -72.03 141.06 30.95 Favored Glycine 0 CA--C 1.525 0.677 0 C-N-CA 124.152 0.882 . . . . 0.0 112.547 -178.138 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 33.3 m -132.63 139.72 49.18 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 C-N-CA 124.497 1.119 . . . . 0.0 112.001 -178.545 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 79.2 t80 -75.32 113.69 12.99 Favored 'General case' 0 CA--C 1.54 0.589 0 O-C-N 121.4 -0.813 . . . . 0.0 111.284 179.581 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -82.3 118.21 22.97 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.371 1.068 . . . . 0.0 110.447 170.67 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 11.6 mp0 -73.87 -28.11 61.41 Favored 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 114.017 1.117 . . . . 0.0 114.017 -173.335 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 32.8 tp10 -81.52 -41.92 20.97 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.228 1.011 . . . . 0.0 111.914 -179.41 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 36.0 t -74.62 -35.88 62.93 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 125.016 1.326 . . . . 0.0 112.015 173.072 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 80.91 33.1 30.79 Favored Glycine 0 CA--C 1.534 1.246 0 C-N-CA 124.491 1.043 . . . . 0.0 113.053 -177.042 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 69.9 mm-40 -144.93 149.95 36.15 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 125.138 1.375 . . . . 0.0 111.716 -171.518 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 84.5 m95 -76.89 134.5 38.96 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 122.723 0.409 . . . . 0.0 110.555 170.032 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 8.1 m -139.41 145.05 27.71 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 C-N-CA 124.658 1.183 . . . . 0.0 113.007 -168.765 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 2.8 m0 -93.81 97.6 10.52 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 106.715 -1.587 . . . . 0.0 106.715 167.623 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 61.6 mttm -74.32 145.07 44.21 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 124.447 1.099 . . . . 0.0 111.959 -175.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 62.9 t30 52.16 37.12 20.91 Favored 'General case' 0 CA--C 1.551 0.994 0 C-N-CA 126.33 1.852 . . . . 0.0 113.201 -170.588 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 88.4 m -119.18 147.13 44.55 Favored 'General case' 0 N--CA 1.481 1.108 0 O-C-N 120.67 -1.269 . . . . 0.0 112.252 -176.148 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 13.2 tt -136.66 145.65 29.94 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.64 0 C-N-CA 127.888 2.475 . . . . 0.0 110.719 -178.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 73.5 tt0 -105.7 125.68 51.27 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.569 1.148 . . . . 0.0 110.564 169.793 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 8.3 p -158.93 145.84 7.5 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 C-N-CA 124.997 1.319 . . . . 0.0 110.655 179.876 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 53.9 t30 53.01 38.73 28.04 Favored 'General case' 0 CA--C 1.554 1.111 0 C-N-CA 124.431 1.092 . . . . 0.0 112.55 -177.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 65.95 14.89 61.81 Favored Glycine 0 CA--C 1.534 1.257 0 C-N-CA 125.51 1.529 . . . . 0.0 115.971 -179.844 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 35.8 mtmm -134.83 159.95 39.76 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 126.349 1.86 . . . . 0.0 110.938 -177.278 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 70.4 m-85 -91.03 149.7 21.73 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-O 121.979 0.895 . . . . 0.0 112.08 169.866 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 9.8 m-85 -145.9 165.31 29.31 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 127.283 2.233 . . . . 0.0 109.387 177.576 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 596' ' ' HIS . . . . . . . . . . . . . 26.7 m80 -77.94 141.88 38.73 Favored 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 108.161 -1.052 . . . . 0.0 108.161 166.102 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 8.4 t -65.94 -41.73 90.94 Favored 'General case' 0 N--CA 1.466 0.353 0 O-C-N 121.805 -0.559 . . . . 0.0 112.018 -177.186 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 22.3 p -64.72 -42.64 95.09 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 123.608 0.763 . . . . 0.0 112.683 173.666 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 599' ' ' CYS . . . . . . . . . . . . . 64.2 m -56.14 -58.27 8.66 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.589 1.155 . . . . 0.0 110.824 174.617 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 76.5 t80 -58.69 -46.77 86.51 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.414 0.686 . . . . 0.0 112.456 179.793 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 33.9 t-80 -58.73 -47.21 85.39 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 124.102 0.961 . . . . 0.0 113.129 -176.662 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 35.5 tp10 -77.29 -30.5 54.23 Favored 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 112.72 0.637 . . . . 0.0 112.72 -179.902 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 98.6 m -81.21 -34.03 32.52 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.761 0.825 . . . . 0.0 112.981 -176.787 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 604' ' ' SER . . . . . . . . . . . . . 38.0 t -64.06 129.93 41.97 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 124.254 1.022 . . . . 0.0 112.915 -174.068 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 605' ' ' GLN . . . . . . . . . . . . . 14.4 tt0 -115.48 135.78 53.75 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.869 1.668 . . . . 0.0 109.867 172.804 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 606' ' ' ASN . . . . . . . . . . . . . 56.3 m-80 -139.13 154.52 48.12 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.153 1.381 . . . . 0.0 111.837 -171.481 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 607' ' ' SER . . . . . . . . . . . . . 17.4 t -71.39 151.29 44.2 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.609 1.164 . . . . 0.0 112.479 178.788 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 608' ' ' SER . . . . . . . . . . . . . 46.1 m . . . . . 0 C--O 1.255 1.37 0 C-N-CA 126.062 1.745 . . . . 0.0 113.816 -177.209 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 533' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.371 0 N-CA-C 111.088 -0.805 . . . . 0.0 111.088 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 104.38 17.14 16.2 Favored Glycine 0 CA--C 1.538 1.529 0 C-N-CA 125.354 1.454 . . . . 0.0 115.574 178.746 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 535' ' ' SER . . . . . . . . . . . . . 23.4 t -139.18 -15.32 1.12 Allowed 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 125.042 1.337 . . . . 0.0 113.722 -178.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 536' ' ' GLU . . . . . . . . . . . . . 18.9 mp0 -68.84 6.06 0.97 Allowed 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 127.164 2.186 . . . . 0.0 115.953 -170.918 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 537' ' ' PHE . . . . . . . . . . . . . 47.6 p90 -67.32 -18.14 65.05 Favored 'General case' 0 CA--C 1.546 0.802 0 O-C-N 120.527 -1.358 . . . . 0.0 112.77 169.531 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 96.7 p -150.76 157.27 42.74 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 126.192 1.797 . . . . 0.0 110.596 169.519 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 539' ' ' ASP . . . . . . . . . . . . . 30.8 m-20 -142.53 154.35 44.41 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 124.555 1.142 . . . . 0.0 112.958 -175.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 540' ' ' ARG . . . . . . . . . . . . . 30.8 mmt180 -89.13 22.95 2.59 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 125.605 1.562 . . . . 0.0 112.424 170.659 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 92.9 p -74.96 175.56 8.0 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 126.351 1.86 . . . . 0.0 113.279 -172.55 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 542' ' ' ASN . . . . . . . . . . . . . 29.1 m120 -63.35 -11.42 22.32 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 114.039 1.126 . . . . 0.0 114.039 178.731 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 22.0 tp10 -52.78 -53.21 51.42 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-N 119.993 1.269 . . . . 0.0 111.977 178.711 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 85.7 mt -65.49 -33.14 75.25 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 123.5 0.72 . . . . 0.0 112.438 179.404 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -73.78 -41.63 62.14 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 124.092 0.957 . . . . 0.0 112.651 -177.321 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 33.9 mm -71.46 -31.61 43.52 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.658 0 C-N-CA 124.342 1.057 . . . . 0.0 110.847 173.451 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 19.0 tpp180 -68.14 -34.62 76.7 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 124.333 1.053 . . . . 0.0 111.767 175.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -72.61 -6.14 65.73 Favored Glycine 0 CA--C 1.537 1.424 0 C-N-CA 125.76 1.648 . . . . 0.0 115.645 177.176 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 73.4 mmtt -76.67 125.84 29.94 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-N 119.576 1.688 . . . . 0.0 110.289 171.897 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 39.5 p90 -149.29 162.89 39.15 Favored 'General case' 0 C--O 1.237 0.404 0 N-CA-C 113.277 0.843 . . . . 0.0 113.277 176.619 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -135.68 138.13 48.37 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.485 0 C-N-CA 126.274 1.83 . . . . 0.0 110.422 179.044 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 76.2 t -70.54 134.92 29.18 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.939 0 C-N-CA 123.821 0.849 . . . . 0.0 110.812 -175.61 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 72.7 t -64.96 121.79 75.87 Favored Pre-proline 0 CA--C 1.544 0.719 0 C-N-CA 124.22 1.008 . . . . 0.0 108.957 173.491 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -87.0 -9.11 6.42 Favored 'Trans proline' 0 CA--C 1.536 0.586 0 C-N-CA 124.583 3.522 . . . . 0.0 114.54 -169.144 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 63.48 -24.63 0.07 Allowed 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 127.826 2.45 . . . . 0.0 114.627 -168.408 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 80.6 p -64.53 -18.91 65.26 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 124.989 1.315 . . . . 0.0 111.995 169.333 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 33.5 p -65.56 -8.24 18.86 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 126.692 1.997 . . . . 0.0 114.184 168.493 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? 68.26 -36.78 0.32 Allowed 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 128.408 2.683 . . . . 0.0 116.644 169.751 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 28.9 t0 -125.54 14.24 8.17 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 125.167 1.387 . . . . 0.0 113.45 178.319 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 80.2 mtp 56.63 22.48 6.77 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 126.276 1.83 . . . . 0.0 114.368 -179.49 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -133.3 152.51 51.93 Favored 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 125.818 1.647 . . . . 0.0 112.012 -170.089 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 10.5 m-85 -148.82 156.43 42.33 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 125.527 1.531 . . . . 0.0 111.823 171.495 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 47.2 tttp -85.81 153.01 22.57 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 124.385 1.074 . . . . 0.0 113.248 -178.634 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 13.7 t -104.89 101.78 31.49 Favored Pre-proline 0 CA--C 1.547 0.831 0 C-N-CA 126.559 1.943 . . . . 0.0 109.128 165.017 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -61.33 -21.16 71.02 Favored 'Trans proline' 0 CA--C 1.541 0.825 0 C-N-CA 122.726 2.284 . . . . 0.0 115.496 176.76 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 89.3 mt -72.87 -58.07 5.71 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 C-N-CA 124.495 1.118 . . . . 0.0 111.658 -177.691 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 14.4 p -98.12 2.62 48.77 Favored 'General case' 0 CA--C 1.552 1.055 0 C-N-CA 123.977 0.911 . . . . 0.0 113.346 179.406 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 568' ' ' LYS . . . . . . . . . . . . 0.326 20.1 ptpt 54.85 42.85 30.81 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 127.566 2.346 . . . . 0.0 113.434 -177.401 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 71.2 mm-40 -109.84 -177.27 3.22 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.624 0.77 . . . . 0.0 112.196 179.26 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 64.4 m -132.34 120.99 22.82 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 124.556 1.142 . . . . 0.0 110.977 178.218 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -81.74 149.77 4.73 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 C-N-CA 124.456 1.102 . . . . 0.0 110.258 168.056 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 3.4 t -149.0 155.62 41.06 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.969 0.907 . . . . 0.0 112.388 171.436 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -58.47 148.28 38.09 Favored Glycine 0 CA--C 1.534 1.251 0 C-N-CA 126.18 1.848 . . . . 0.0 116.661 -168.648 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 60.8 t -136.2 132.6 49.76 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 C-N-CA 125.691 1.596 . . . . 0.0 111.567 173.413 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 57.7 t80 -73.67 127.69 33.46 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 113.327 0.862 . . . . 0.0 113.327 -175.113 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 22.7 t0 -99.37 122.76 42.95 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 125.705 1.602 . . . . 0.0 110.45 169.237 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 64.7 mt-10 -73.55 -24.27 60.1 Favored 'General case' 0 CA--C 1.544 0.74 0 N-CA-C 113.793 1.035 . . . . 0.0 113.793 177.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -77.16 -52.48 9.2 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 119.401 1.001 . . . . 0.0 112.115 -176.234 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 89.9 p -74.42 -24.98 59.17 Favored 'General case' 0 N--CA 1.479 0.995 0 O-C-N 121.548 -0.72 . . . . 0.0 112.048 169.296 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 78.31 28.81 55.06 Favored Glycine 0 CA--C 1.536 1.403 0 C-N-CA 124.501 1.048 . . . . 0.0 113.15 -179.62 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -143.2 159.03 43.07 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.718 1.607 . . . . 0.0 112.645 -172.304 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 82.3 m95 -78.73 137.39 37.75 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.805 0.842 . . . . 0.0 111.677 176.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 19.2 m -130.0 151.28 35.62 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.762 0 C-N-CA 126.261 1.824 . . . . 0.0 112.912 -178.032 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 5.7 m0 -97.09 104.35 16.36 Favored 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 126.452 1.901 . . . . 0.0 110.553 169.321 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -70.87 148.39 47.85 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 124.221 1.009 . . . . 0.0 111.987 179.091 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 48.3 t30 50.45 45.48 26.34 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 124.855 1.262 . . . . 0.0 112.518 -179.785 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 94.2 m -130.93 145.84 52.15 Favored 'General case' 0 N--CA 1.48 1.052 0 N-CA-C 113.95 1.092 . . . . 0.0 113.95 -170.113 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 8.3 tt -143.33 151.72 16.89 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.62 0 C-N-CA 128.078 2.551 . . . . 0.0 110.477 -177.792 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 73.1 tt0 -119.03 126.8 52.55 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.338 1.455 . . . . 0.0 109.792 169.696 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 2.8 t -142.01 131.98 24.22 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 C-N-CA 126.78 2.032 . . . . 0.0 109.868 -175.795 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 16.5 m120 52.44 36.87 21.22 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 124.91 1.284 . . . . 0.0 113.931 178.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 78.67 8.93 87.47 Favored Glycine 0 CA--C 1.54 1.625 0 C-N-CA 124.796 1.189 . . . . 0.0 115.518 -179.752 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 53.0 mtmt -126.56 148.57 49.73 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 126.209 1.804 . . . . 0.0 111.431 -178.646 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 20.9 m-85 -89.58 149.12 22.99 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.167 0.987 . . . . 0.0 111.979 177.004 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 94.2 m-85 -151.34 162.85 40.18 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 125.783 1.633 . . . . 0.0 111.345 -179.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 596' ' ' HIS . . . . . . . . . . . . . 24.6 m80 -78.44 140.58 38.64 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 167.901 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 19.7 m -64.86 -39.52 93.68 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 118.36 0.527 . . . . 0.0 111.673 179.223 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 22.6 p -62.4 -46.08 90.24 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 123.721 0.808 . . . . 0.0 112.943 172.781 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 599' ' ' CYS . . . . . . . . . . . . . 94.0 m -60.04 -54.41 46.35 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 124.226 1.01 . . . . 0.0 111.312 177.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 89.7 t80 -62.32 -41.71 98.77 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.293 0.637 . . . . 0.0 112.126 -179.18 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 12.9 t-160 -61.29 -44.36 97.34 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.087 0.955 . . . . 0.0 112.388 176.348 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 25.8 tt0 -71.94 -34.39 68.98 Favored 'General case' 0 CA--C 1.545 0.788 0 N-CA-C 113.291 0.849 . . . . 0.0 113.291 178.612 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 92.1 m -89.51 -42.41 11.47 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 113.871 1.063 . . . . 0.0 113.871 -172.26 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 604' ' ' SER . . . . . . . . . . . . . 8.5 t -83.68 72.88 10.31 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 113.617 0.969 . . . . 0.0 113.617 -169.293 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 605' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -66.31 -20.76 66.18 Favored 'General case' 0 CA--C 1.544 0.75 0 O-C-N 121.319 -0.863 . . . . 0.0 112.293 172.07 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 606' ' ' ASN . . . . . . . . . . . . . 82.6 m-20 -67.93 -25.44 65.47 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.373 1.069 . . . . 0.0 113.356 175.538 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 607' ' ' SER . . . . . . . . . . . . . 14.1 t -74.12 -16.95 61.0 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.83 1.252 . . . . 0.0 113.872 -179.386 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 608' ' ' SER . . . . . . . . . . . . . 49.5 m . . . . . 0 C--O 1.253 1.286 0 C-N-CA 126.262 1.825 . . . . 0.0 114.348 -178.788 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 533' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.635 0 N-CA-C 111.498 -0.641 . . . . 0.0 111.498 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . -72.12 158.89 53.55 Favored Glycine 0 CA--C 1.539 1.541 0 C-N-CA 124.211 0.91 . . . . 0.0 114.195 178.256 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 535' ' ' SER . . . . . . . . . . . . . 27.0 m -65.7 141.94 58.19 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.792 1.237 . . . . 0.0 112.918 179.764 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 536' ' ' GLU . . . . . . . . . . . . . 70.7 mt-10 -78.52 149.41 33.11 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 124.437 1.095 . . . . 0.0 112.706 175.896 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 537' ' ' PHE . . . . . . . . . . . . . 37.1 p90 -80.87 158.81 25.21 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 124.822 1.249 . . . . 0.0 112.872 175.248 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 22.0 t -70.75 154.29 41.99 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 125.127 1.371 . . . . 0.0 113.546 -178.739 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 539' ' ' ASP . . . . . . . . . . . . . 33.0 p30 -137.16 160.76 38.05 Favored 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 126.411 1.884 . . . . 0.0 112.336 175.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 540' ' ' ARG . . . . . . . . . . . . . 27.5 mmm180 -103.49 24.45 11.04 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 125.355 1.462 . . . . 0.0 114.041 -169.082 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 20.4 m -60.7 149.15 36.26 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 125.821 1.648 . . . . 0.0 114.502 -171.64 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 542' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -62.08 -18.14 59.78 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 124.906 1.282 . . . . 0.0 114.17 -177.777 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -59.29 -23.46 62.43 Favored 'General case' 0 N--CA 1.476 0.847 0 O-C-N 120.965 -1.085 . . . . 0.0 113.331 172.013 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 76.1 mt -82.38 -18.27 42.59 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.01 1.324 . . . . 0.0 113.479 172.254 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 35.2 tp10 -91.34 -37.52 13.19 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 124.842 1.257 . . . . 0.0 113.108 -176.397 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 29.6 mm -60.96 -38.09 78.59 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.014 0 CA-C-N 118.828 0.74 . . . . 0.0 111.333 175.691 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 19.8 ptp180 -75.43 -17.8 60.07 Favored 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 113.575 0.954 . . . . 0.0 113.575 -179.676 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -80.88 -9.57 86.13 Favored Glycine 0 CA--C 1.531 1.094 0 C-N-CA 124.77 1.176 . . . . 0.0 114.562 -179.38 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 69.3 mmtt -73.58 143.68 46.31 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 118.522 1.161 . . . . 0.0 112.221 179.581 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 40.6 p90 -159.69 167.21 28.9 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 125.292 1.437 . . . . 0.0 111.886 173.848 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 2.6 m -133.65 141.9 43.0 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.725 0 C-N-CA 125.928 1.691 . . . . 0.0 110.252 171.22 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 7.4 p -76.47 137.22 23.04 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.059 0 O-C-N 121.156 -0.965 . . . . 0.0 112.642 -170.241 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 72.5 t -75.64 125.68 88.23 Favored Pre-proline 0 N--CA 1.472 0.631 0 C-N-CA 124.475 1.11 . . . . 0.0 109.696 171.554 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_endo -78.34 142.67 19.05 Favored 'Trans proline' 0 CA--C 1.539 0.772 0 C-N-CA 122.994 2.463 . . . . 0.0 111.154 173.538 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -63.18 -17.38 62.33 Favored 'General case' 0 N--CA 1.48 1.037 0 O-C-N 121.016 -1.053 . . . . 0.0 113.063 172.36 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 11.3 m -64.93 -27.04 68.58 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 125.782 1.633 . . . . 0.0 112.71 171.481 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 29.2 t -70.6 125.86 27.99 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-N 119.12 0.873 . . . . 0.0 111.907 179.484 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 45.8 tt0 -74.99 -27.14 60.03 Favored 'General case' 0 CA--C 1.55 0.948 0 N-CA-C 112.953 0.723 . . . . 0.0 112.953 176.402 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 20.3 t0 -118.98 -11.37 9.69 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 114.328 1.233 . . . . 0.0 114.328 -172.363 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 79.8 mtp 56.98 34.85 25.58 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 125.976 1.71 . . . . 0.0 113.391 177.566 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -139.63 153.63 47.37 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 115.586 1.699 . . . . 0.0 115.586 -169.579 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 19.9 m-85 -148.18 174.3 12.12 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 128.449 2.699 . . . . 0.0 108.75 169.734 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 7.3 ttpm? -132.15 142.18 49.38 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 124.287 1.035 . . . . 0.0 113.114 -175.059 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 22.3 t -83.11 114.99 56.58 Favored Pre-proline 0 CA--C 1.546 0.819 0 C-N-CA 127.948 2.499 . . . . 0.0 111.03 172.778 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -63.5 -26.38 70.14 Favored 'Trans proline' 0 CA--C 1.538 0.705 0 C-N-CA 123.144 2.563 . . . . 0.0 114.985 173.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 89.8 mt -70.35 -55.44 14.51 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.885 0 C-N-CA 124.359 1.063 . . . . 0.0 111.552 -173.581 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 14.3 p -103.54 1.13 31.85 Favored 'General case' 0 CA--C 1.553 1.086 0 C-N-CA 124.79 1.236 . . . . 0.0 113.587 179.725 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 568' ' ' LYS . . . . . . . . . . . . . 29.6 mtpp 60.65 41.45 15.21 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 126.447 1.899 . . . . 0.0 112.448 -179.832 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 77.1 mt-10 -114.23 133.89 55.31 Favored 'General case' 0 N--CA 1.486 1.331 0 N-CA-C 114.208 1.188 . . . . 0.0 114.208 -174.033 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 89.3 m -83.58 118.43 23.8 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 124.051 0.94 . . . . 0.0 111.289 177.573 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 3.5 m -81.95 149.09 4.91 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 124.566 1.146 . . . . 0.0 110.715 168.805 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 82.3 p -133.08 156.36 47.54 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 125.504 1.522 . . . . 0.0 111.273 177.008 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -65.58 140.82 41.39 Favored Glycine 0 CA--C 1.532 1.109 0 N-CA-C 115.043 0.777 . . . . 0.0 115.043 -178.763 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 85.6 t -134.49 131.47 54.39 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 C-N-CA 125.236 1.414 . . . . 0.0 110.492 178.489 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 74.6 t80 -73.89 123.9 25.13 Favored 'General case' 0 CA--C 1.543 0.673 0 N-CA-C 113.573 0.953 . . . . 0.0 113.573 -173.731 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 54.0 t0 -92.64 114.93 27.62 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.214 1.406 . . . . 0.0 109.559 169.233 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -71.32 -27.07 63.13 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 114.062 1.134 . . . . 0.0 114.062 -175.648 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 50.1 mm-40 -88.18 -39.26 14.64 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 124.282 1.033 . . . . 0.0 112.034 -179.591 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 32.4 t -70.84 -35.01 72.24 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 122.964 0.506 . . . . 0.0 112.058 169.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 81.35 25.57 54.19 Favored Glycine 0 CA--C 1.534 1.222 0 C-N-CA 125.058 1.313 . . . . 0.0 112.921 -176.482 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 78.8 mm-40 -141.57 152.65 44.25 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.89 1.276 . . . . 0.0 111.876 -170.461 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 84.2 m95 -77.06 138.68 39.7 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 123.862 0.865 . . . . 0.0 110.757 171.584 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 23.4 m -135.24 148.72 28.63 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 C-N-CA 125.415 1.486 . . . . 0.0 113.31 -175.63 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 4.1 m0 -87.63 99.62 12.2 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 126.534 1.934 . . . . 0.0 109.169 169.694 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 32.6 mmtp -68.72 148.44 50.37 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 124.093 0.957 . . . . 0.0 111.881 -178.245 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 64.2 t30 53.63 33.43 16.47 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 125.763 1.625 . . . . 0.0 113.144 179.221 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 90.1 m -116.87 142.83 46.43 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 124.05 0.94 . . . . 0.0 112.645 -171.736 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 11.1 tt -134.94 144.91 33.29 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 C-N-CA 127.71 2.404 . . . . 0.0 110.116 -179.638 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 73.6 tt0 -112.18 136.99 50.89 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 124.683 1.193 . . . . 0.0 110.713 171.272 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 12.7 p -148.56 136.12 13.97 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 C-N-CA 124.421 1.088 . . . . 0.0 110.925 172.268 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 66.0 t30 51.22 37.21 17.87 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 125.038 1.335 . . . . 0.0 113.537 177.761 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 78.1 8.3 87.44 Favored Glycine 0 CA--C 1.537 1.424 0 C-N-CA 124.829 1.204 . . . . 0.0 116.086 -179.279 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -122.94 149.61 44.04 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 125.92 1.688 . . . . 0.0 111.879 -178.147 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 72.6 m-85 -98.69 147.12 25.17 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.633 1.173 . . . . 0.0 113.176 -179.665 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 98.6 m-85 -150.85 168.89 23.1 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 126.551 1.94 . . . . 0.0 110.706 179.664 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 596' ' ' HIS . . . . . . . . . . . . . 22.8 m80 -86.17 144.17 27.62 Favored 'General case' 0 N--CA 1.471 0.605 0 O-C-N 121.288 -0.882 . . . . 0.0 110.08 168.057 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 15.6 m -65.35 -43.54 90.55 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 123.42 0.688 . . . . 0.0 111.969 179.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 22.2 p -64.64 -37.69 88.44 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 124.013 0.925 . . . . 0.0 112.966 174.29 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 599' ' ' CYS . . . . . . . . . . . . . 89.6 m -65.86 -59.76 3.54 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.135 0.974 . . . . 0.0 110.965 176.211 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 75.8 t80 -59.13 -38.39 79.52 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.169 0.988 . . . . 0.0 113.481 -175.245 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 76.6 t60 -56.69 -58.3 8.69 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 114.712 1.375 . . . . 0.0 114.712 -173.198 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 15.2 tt0 -98.14 -10.87 23.5 Favored 'General case' 0 CA--C 1.545 0.767 0 N-CA-C 113.637 0.977 . . . . 0.0 113.637 -174.387 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 98.6 m -80.77 -35.42 33.23 Favored 'General case' 0 N--CA 1.485 1.276 0 O-C-N 121.157 -0.964 . . . . 0.0 112.242 179.42 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 604' ' ' SER . . . . . . . . . . . . . 23.3 t -68.11 150.26 48.6 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 123.582 0.753 . . . . 0.0 112.678 178.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 605' ' ' GLN . . . . . . . . . . . . . 64.7 tt0 -74.95 83.82 2.23 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 124.153 0.981 . . . . 0.0 110.194 171.813 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 606' ' ' ASN . . . . . . . . . . . . . 81.6 m-20 -67.71 161.01 26.89 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 124.331 1.053 . . . . 0.0 112.424 177.626 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 607' ' ' SER . . . . . . . . . . . . . 22.8 t -139.31 157.85 45.18 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 125.136 1.374 . . . . 0.0 112.364 -175.641 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 608' ' ' SER . . . . . . . . . . . . . 26.9 m . . . . . 0 C--O 1.253 1.267 0 C-N-CA 126.643 1.977 . . . . 0.0 114.052 -175.576 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 533' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.527 0 N-CA-C 111.297 -0.721 . . . . 0.0 111.297 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . -79.72 -8.3 87.82 Favored Glycine 0 CA--C 1.539 1.577 0 N-CA-C 115.864 1.105 . . . . 0.0 115.864 -177.787 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 535' ' ' SER . . . . . . . . . . . . . 9.1 t -152.62 167.61 28.33 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.38 1.472 . . . . 0.0 111.92 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 536' ' ' GLU . . . . . . . . . . . . . 17.1 pt-20 -69.05 155.77 39.79 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 124.764 1.226 . . . . 0.0 113.795 -179.75 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 537' ' ' PHE . . . . . . . . . . . . . 95.5 m-85 -71.31 148.99 46.55 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 124.015 0.926 . . . . 0.0 112.706 175.004 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 77.7 p -76.24 166.06 24.0 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 124.057 0.943 . . . . 0.0 112.624 173.213 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 539' ' ' ASP . . . . . . . . . . . . . 29.3 t0 -78.36 18.52 0.53 Allowed 'General case' 0 CA--C 1.553 1.094 0 C-N-CA 125.495 1.518 . . . . 0.0 114.281 -178.178 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 540' ' ' ARG . . . . . . . . . . . . . 84.3 mtt85 -69.8 153.85 42.78 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 125.25 1.42 . . . . 0.0 112.774 179.487 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 79.6 p -68.82 156.5 38.29 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.887 1.275 . . . . 0.0 112.634 171.571 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 542' ' ' ASN . . . . . . . . . . . . . 30.9 t-20 -72.6 126.76 30.65 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 123.855 0.862 . . . . 0.0 111.715 -177.419 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -113.74 -26.17 8.34 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 125.488 1.515 . . . . 0.0 113.232 172.416 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 63.6 tp -63.77 -40.22 96.16 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.986 0.914 . . . . 0.0 112.59 -177.336 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 63.3 mt-10 -74.32 -18.82 60.65 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 113.425 0.898 . . . . 0.0 113.425 176.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 16.7 mm -75.0 -41.76 45.69 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.554 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 168.764 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 7.3 tmm_? -66.37 -36.35 82.65 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 124.111 0.964 . . . . 0.0 111.39 178.919 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -67.15 -6.4 39.02 Favored Glycine 0 CA--C 1.535 1.307 0 C-N-CA 125.704 1.621 . . . . 0.0 116.561 175.801 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt -70.95 134.37 47.14 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-N 119.754 1.777 . . . . 0.0 110.991 171.494 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 41.6 p90 -148.49 166.74 27.29 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 114.443 1.275 . . . . 0.0 114.443 179.697 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -136.91 138.99 45.4 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 C-N-CA 126.776 2.03 . . . . 0.0 109.241 173.722 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 83.8 t -70.48 132.02 33.67 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.994 0 O-C-N 121.043 -1.036 . . . . 0.0 110.908 -174.701 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 87.3 t -71.72 124.87 91.55 Favored Pre-proline 0 CA--C 1.541 0.629 0 C-N-CA 125.331 1.453 . . . . 0.0 109.963 175.268 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 95.5 Cg_endo -78.87 152.21 24.92 Favored 'Trans proline' 0 C--N 1.349 0.567 0 C-N-CA 123.036 2.49 . . . . 0.0 112.19 177.293 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 56.1 mt-10 -62.54 -21.67 65.74 Favored 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 113.215 0.82 . . . . 0.0 113.215 174.001 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 67.8 p -78.61 -11.85 59.99 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 125.89 1.676 . . . . 0.0 113.882 176.104 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 88.5 p -63.7 144.26 57.17 Favored 'General case' 0 N--CA 1.48 1.032 0 CA-C-N 119.242 0.928 . . . . 0.0 112.756 178.062 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 64.5 mt-30 -83.12 118.62 23.7 Favored 'General case' 0 N--CA 1.467 0.404 0 O-C-N 121.449 -0.782 . . . . 0.0 109.287 169.657 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 38.0 m-20 52.15 24.31 2.7 Favored 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 126.415 1.886 . . . . 0.0 115.197 177.47 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 8.9 mtt 54.75 36.21 25.81 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.97 1.308 . . . . 0.0 113.65 -176.453 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -125.03 147.09 49.13 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 114.368 1.247 . . . . 0.0 114.368 -171.491 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 6.5 t80 -155.48 166.4 33.66 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 125.611 1.564 . . . . 0.0 111.084 172.193 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 39.5 ttmt -107.61 148.7 28.97 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 124.907 1.283 . . . . 0.0 114.352 -171.129 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 33.9 t -95.15 110.45 50.28 Favored Pre-proline 0 CA--C 1.543 0.709 0 C-N-CA 128.384 2.674 . . . . 0.0 110.033 167.905 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -64.66 -21.7 65.05 Favored 'Trans proline' 0 CA--C 1.538 0.701 0 C-N-CA 123.037 2.491 . . . . 0.0 115.425 177.649 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 85.0 mt -70.95 -55.46 13.99 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.928 0 C-N-CA 124.025 0.93 . . . . 0.0 110.873 -177.436 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 14.7 p -103.38 0.1 30.83 Favored 'General case' 0 CA--C 1.552 1.052 0 N-CA-C 113.909 1.078 . . . . 0.0 113.909 -178.251 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 568' ' ' LYS . . . . . . . . . . . . 0.332 25.0 pttm 55.32 46.1 24.18 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 127.775 2.43 . . . . 0.0 113.419 -175.481 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 69.6 mm-40 -121.16 150.15 41.72 Favored 'General case' 0 N--CA 1.483 1.176 0 N-CA-C 113.715 1.006 . . . . 0.0 113.715 -175.583 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 89.1 m -93.46 120.79 34.16 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 124.108 0.963 . . . . 0.0 112.303 -176.111 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 2.6 m -79.14 147.16 6.94 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.671 0 C-N-CA 124.215 1.006 . . . . 0.0 110.084 167.326 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 68.6 p -127.53 148.05 50.33 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 124.52 1.128 . . . . 0.0 111.386 175.547 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -70.75 147.39 43.34 Favored Glycine 0 CA--C 1.534 1.26 0 C-N-CA 123.887 0.756 . . . . 0.0 114.001 -178.55 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 85.9 t -133.62 136.37 54.42 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 C-N-CA 125.362 1.465 . . . . 0.0 111.185 177.235 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 63.8 t80 -72.99 118.87 16.47 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 123.478 0.711 . . . . 0.0 112.78 -176.622 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 63.4 t0 -82.68 110.52 17.81 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 168.436 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 57.9 mt-10 -68.12 -25.86 65.51 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 124.692 1.197 . . . . 0.0 113.946 -175.445 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 38.0 tp10 -80.51 -48.44 12.78 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 123.255 0.622 . . . . 0.0 112.229 -176.371 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 99.1 p -78.82 -28.72 44.48 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 123.52 0.728 . . . . 0.0 112.473 173.416 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 82.15 31.13 32.34 Favored Glycine 0 CA--C 1.538 1.474 0 C-N-CA 124.853 1.216 . . . . 0.0 112.606 -177.049 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 56.2 mt-10 -135.34 145.59 47.57 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 118.636 1.218 . . . . 0.0 111.311 -173.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 69.9 m95 -77.54 141.02 39.82 Favored 'General case' 0 N--CA 1.466 0.342 0 O-C-N 121.273 -0.892 . . . . 0.0 111.523 177.235 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 17.3 m -135.91 142.59 38.6 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 C-N-CA 125.853 1.661 . . . . 0.0 112.757 -172.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 2.0 m0 -88.97 95.36 10.29 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 125.175 1.39 . . . . 0.0 108.019 170.168 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -69.5 160.94 30.51 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 124.291 1.036 . . . . 0.0 111.396 175.007 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 54.61 32.05 16.31 Favored 'General case' 0 CA--C 1.553 1.074 0 C-N-CA 125.04 1.336 . . . . 0.0 112.607 -177.92 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 73.0 m -125.15 146.73 49.36 Favored 'General case' 0 N--CA 1.479 0.984 0 O-C-N 120.978 -1.077 . . . . 0.0 113.564 -169.492 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 18.1 tt -143.19 149.29 18.55 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 C-N-CA 127.085 2.154 . . . . 0.0 110.85 177.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 72.6 tt0 -107.89 122.27 46.45 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 124.482 1.113 . . . . 0.0 110.002 168.744 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 2.0 t -144.16 142.11 24.29 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.866 0 C-N-CA 126.332 1.853 . . . . 0.0 109.682 -174.559 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 23.8 t-20 52.27 26.64 4.14 Favored 'General case' 0 CA--C 1.554 1.128 0 C-N-CA 125.526 1.531 . . . . 0.0 114.189 177.537 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 88.42 1.79 80.6 Favored Glycine 0 CA--C 1.54 1.646 0 C-N-CA 125.721 1.629 . . . . 0.0 116.455 -177.786 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 2.7 mptt -128.43 161.18 30.08 Favored 'General case' 0 N--CA 1.479 1.01 0 CA-C-N 119.42 1.61 . . . . 0.0 113.285 -177.823 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 3.6 m-85 -81.78 148.9 28.65 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 115.541 -0.754 . . . . 0.0 111.59 171.746 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 64.2 m-85 -152.87 161.79 42.11 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 126.334 1.853 . . . . 0.0 110.854 -178.106 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 596' ' ' HIS . . . . . . . . . . . . . 21.1 m80 -76.97 136.14 38.73 Favored 'General case' 0 N--CA 1.473 0.698 0 N-CA-C 108.259 -1.015 . . . . 0.0 108.259 167.222 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 47.8 p -59.39 -37.45 77.99 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 123.532 0.733 . . . . 0.0 112.375 178.114 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 5.7 p -70.31 -50.51 38.48 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.723 1.209 . . . . 0.0 112.637 175.171 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 599' ' ' CYS . . . . . . . . . . . . . 91.4 m -51.51 -52.26 48.34 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.278 1.031 . . . . 0.0 111.423 175.007 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 53.6 t80 -58.51 -52.21 66.61 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 123.483 0.713 . . . . 0.0 111.734 176.605 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 51.6 t-80 -61.81 -38.53 88.48 Favored 'General case' 0 N--CA 1.475 0.824 0 N-CA-C 113.372 0.878 . . . . 0.0 113.372 -176.489 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -71.07 -18.9 62.53 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 113.736 1.014 . . . . 0.0 113.736 175.567 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 88.7 m -101.25 -65.94 0.94 Allowed 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 124.624 1.17 . . . . 0.0 112.132 -177.733 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 604' ' ' SER . . . . . . . . . . . . . 52.0 m 55.22 -49.67 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 129.742 3.217 . . . . 0.0 117.816 -174.488 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 605' ' ' GLN . . . . . . . . . . . . . 59.5 mm-40 -77.8 156.51 30.44 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 126.335 1.854 . . . . 0.0 113.269 -174.518 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 606' ' ' ASN . . . . . . . . . . . . . 67.1 t30 50.47 60.85 3.55 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 126.566 1.946 . . . . 0.0 114.717 168.721 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 607' ' ' SER . . . . . . . . . . . . . 33.4 t -61.88 -34.03 75.27 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 113.754 1.02 . . . . 0.0 113.754 -175.885 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 608' ' ' SER . . . . . . . . . . . . . 22.7 t . . . . . 0 C--O 1.255 1.38 0 C-N-CA 125.655 1.582 . . . . 0.0 112.471 175.457 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 533' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.614 0 N-CA-C 111.75 -0.54 . . . . 0.0 111.75 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . -179.52 81.55 0.06 OUTLIER Glycine 0 CA--C 1.532 1.111 0 C-N-CA 124.317 0.961 . . . . 0.0 112.599 -179.652 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 535' ' ' SER . . . . . . . . . . . . . 36.9 t -66.94 -35.26 79.59 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 124.152 0.981 . . . . 0.0 112.866 -178.641 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 536' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -151.24 145.42 25.36 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.658 1.583 . . . . 0.0 110.591 173.479 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 537' ' ' PHE . . . . . . . . . . . . . 84.9 m-85 -92.83 -2.34 55.99 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 114.902 1.445 . . . . 0.0 114.902 -170.841 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 28.5 t -153.27 144.44 23.04 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 124.666 1.187 . . . . 0.0 112.519 -179.531 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 539' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -152.65 167.25 29.53 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 126.117 1.767 . . . . 0.0 110.514 172.218 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 540' ' ' ARG . . . . . . . . . . . . . 3.7 tpt180 -106.42 11.66 30.59 Favored 'General case' 0 N--CA 1.479 1.007 0 N-CA-C 115.242 1.571 . . . . 0.0 115.242 -171.202 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 40.6 t -70.48 129.64 39.78 Favored 'General case' 0 N--CA 1.473 0.689 0 O-C-N 121.21 -0.931 . . . . 0.0 111.861 177.762 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 542' ' ' ASN . . . . . . . . . . . . . 76.7 m-20 -75.68 -19.63 59.0 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 113.262 0.838 . . . . 0.0 113.262 176.347 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 71.2 tt0 -60.91 -27.91 68.53 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.152 0.981 . . . . 0.0 113.014 -177.15 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 58.4 tp -59.17 -40.84 86.89 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 123.918 0.887 . . . . 0.0 112.348 174.543 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 63.8 mm-40 -75.58 -19.29 59.37 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 125.048 1.339 . . . . 0.0 114.179 -173.804 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 31.1 mm -64.08 -36.51 77.12 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.687 0 C-N-CA 125.065 1.346 . . . . 0.0 112.712 -169.662 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 9.4 ptp180 -70.08 -10.86 60.11 Favored 'General case' 0 N--CA 1.478 0.971 0 N-CA-C 115.756 1.761 . . . . 0.0 115.756 -170.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -77.42 -14.56 82.37 Favored Glycine 0 CA--C 1.539 1.542 0 C-N-CA 123.905 0.765 . . . . 0.0 114.838 178.04 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -71.59 147.05 47.99 Favored 'General case' 0 N--CA 1.477 0.911 0 CA-C-N 118.831 1.316 . . . . 0.0 113.472 -177.118 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 51.6 p90 -154.84 162.48 41.09 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 125.603 1.561 . . . . 0.0 111.698 169.554 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -134.74 137.57 50.79 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 C-N-CA 125.899 1.68 . . . . 0.0 110.295 177.709 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 40.7 t -68.29 132.02 33.06 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 C-N-CA 123.671 0.788 . . . . 0.0 109.951 -179.122 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 21.2 t -73.66 123.69 89.61 Favored Pre-proline 0 N--CA 1.474 0.745 0 C-N-CA 124.144 0.978 . . . . 0.0 109.131 171.075 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_endo -70.59 146.32 54.76 Favored 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 122.5 2.133 . . . . 0.0 111.699 178.045 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -62.98 -18.77 63.64 Favored 'General case' 0 N--CA 1.474 0.75 0 O-C-N 121.367 -0.833 . . . . 0.0 113.157 174.184 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 18.7 m -58.53 -32.76 69.16 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 124.943 1.297 . . . . 0.0 111.726 169.296 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 19.7 t -81.73 101.57 10.19 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.623 0.769 . . . . 0.0 111.372 172.079 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 93.0 mt-30 -71.86 -30.66 65.67 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 123.289 0.636 . . . . 0.0 112.242 175.071 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 76.5 m-20 -91.12 -19.7 22.83 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.152 0.981 . . . . 0.0 113.456 -177.348 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 6.2 mtt 55.76 33.08 20.72 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 125.815 1.646 . . . . 0.0 114.95 178.779 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -133.25 136.61 45.66 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.027 0.931 . . . . 0.0 113.24 -175.317 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -143.61 161.1 39.38 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 126.329 1.852 . . . . 0.0 110.753 175.53 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 23.7 tptt -94.75 157.85 15.77 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 124.442 1.097 . . . . 0.0 113.626 -173.957 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 15.2 t -109.98 96.45 25.08 Favored Pre-proline 0 CA--C 1.547 0.838 0 C-N-CA 126.755 2.022 . . . . 0.0 107.566 165.659 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -60.06 -17.61 46.1 Favored 'Trans proline' 0 CA--C 1.548 1.183 0 C-N-CA 122.586 2.191 . . . . 0.0 115.342 177.325 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 73.0 mt -72.58 -58.25 5.41 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.892 0 C-N-CA 124.81 1.244 . . . . 0.0 111.076 -179.942 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 13.7 p -101.93 1.64 37.04 Favored 'General case' 0 CA--C 1.553 1.074 0 N-CA-C 113.964 1.098 . . . . 0.0 113.964 -179.24 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 568' ' ' LYS . . . . . . . . . . . . . 53.6 mtmt 62.37 36.38 14.45 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 128.125 2.57 . . . . 0.0 113.322 -179.033 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 51.2 mm-40 -100.71 173.03 6.72 Favored 'General case' 0 N--CA 1.481 1.124 0 O-C-N 121.731 -0.606 . . . . 0.0 112.539 -177.796 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 59.2 m -118.26 120.97 39.25 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 124.542 1.137 . . . . 0.0 110.71 172.81 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 1.5 m -83.28 121.51 36.26 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.726 0 C-N-CA 124.837 1.255 . . . . 0.0 109.667 169.169 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 47.6 p -106.17 141.72 37.06 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 124.822 1.249 . . . . 0.0 111.263 175.002 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -65.91 148.27 50.88 Favored Glycine 0 CA--C 1.528 0.873 0 C-N-CA 124.099 0.857 . . . . 0.0 113.438 179.241 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 65.0 t -131.21 129.01 62.49 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 C-N-CA 125.743 1.617 . . . . 0.0 111.25 179.909 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 35.1 t80 -74.74 124.38 26.66 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 113.004 0.742 . . . . 0.0 113.004 -175.144 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 64.0 t0 -90.61 106.37 18.46 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.92 1.288 . . . . 0.0 109.156 168.609 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 57.7 mt-10 -66.54 -26.38 67.11 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.051 0.94 . . . . 0.0 113.427 -178.324 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -81.82 -44.72 16.55 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 124.38 1.072 . . . . 0.0 111.798 -178.642 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 53.9 m -77.37 -26.88 52.33 Favored 'General case' 0 N--CA 1.476 0.859 0 N-CA-C 112.946 0.721 . . . . 0.0 112.946 174.318 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 76.99 29.05 57.66 Favored Glycine 0 CA--C 1.539 1.561 0 C-N-CA 125.052 1.311 . . . . 0.0 113.52 -176.445 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 77.4 mm-40 -139.24 150.91 46.05 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 125.839 1.656 . . . . 0.0 111.164 -173.256 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 67.7 m95 -84.73 146.07 27.6 Favored 'General case' 0 N--CA 1.468 0.427 0 O-C-N 121.396 -0.815 . . . . 0.0 110.852 173.468 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 27.9 m -133.49 151.75 33.98 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.977 0 C-N-CA 125.838 1.655 . . . . 0.0 113.678 -178.382 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 3.3 m0 -105.22 107.89 19.12 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 127.241 2.217 . . . . 0.0 107.128 171.606 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -86.24 149.62 24.95 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 125.013 1.325 . . . . 0.0 112.594 -174.791 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 65.0 t30 50.8 32.57 7.31 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 126.106 1.762 . . . . 0.0 113.008 -169.576 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 98.0 m -113.81 146.57 39.76 Favored 'General case' 0 N--CA 1.476 0.833 0 O-C-N 120.92 -1.113 . . . . 0.0 111.993 -172.685 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 9.3 tt -127.55 137.52 57.44 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 C-N-CA 126.779 2.031 . . . . 0.0 110.783 175.101 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -94.98 130.86 41.46 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 125.302 1.441 . . . . 0.0 110.185 169.484 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 12.7 p -150.84 132.42 5.15 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 C-N-CA 124.813 1.245 . . . . 0.0 111.254 174.472 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 77.3 m-20 52.04 40.06 27.65 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 124.935 1.294 . . . . 0.0 114.484 174.504 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 77.4 10.24 86.36 Favored Glycine 0 CA--C 1.541 1.674 0 C-N-CA 125.39 1.472 . . . . 0.0 115.257 -178.866 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 48.6 mttp -133.2 171.65 13.73 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 126.885 2.074 . . . . 0.0 111.03 -170.837 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 84.6 m-85 -121.98 153.09 39.0 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 124.373 1.069 . . . . 0.0 113.673 -176.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 23.8 m-85 -151.87 164.82 36.29 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 126.986 2.115 . . . . 0.0 109.941 175.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 596' ' ' HIS . . . . . . . . . . . . . 25.5 m80 -77.76 138.67 39.14 Favored 'General case' 0 N--CA 1.468 0.46 0 N-CA-C 107.407 -1.331 . . . . 0.0 107.407 165.906 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 5.5 t -64.36 -39.07 93.14 Favored 'General case' 0 CA--C 1.539 0.539 0 O-C-N 121.597 -0.69 . . . . 0.0 111.952 -177.454 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 18.3 p -66.3 -37.28 85.05 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 124.735 1.214 . . . . 0.0 113.61 173.354 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 599' ' ' CYS . . . . . . . . . . . . . 72.3 m -63.88 -54.83 28.67 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 123.797 0.839 . . . . 0.0 110.644 173.337 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 75.9 t80 -57.97 -37.51 74.32 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 125.046 1.339 . . . . 0.0 112.665 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 11.8 t-160 -60.59 -35.52 76.3 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.231 1.012 . . . . 0.0 113.19 176.254 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -79.67 -33.35 41.28 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 113.65 0.982 . . . . 0.0 113.65 176.328 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 69.8 p -89.72 -25.89 20.94 Favored 'General case' 0 N--CA 1.48 1.032 0 N-CA-C 114.645 1.35 . . . . 0.0 114.645 -174.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 604' ' ' SER . . . . . . . . . . . . . 33.9 t -62.81 122.08 15.05 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 123.979 0.912 . . . . 0.0 112.064 -177.45 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 605' ' ' GLN . . . . . . . . . . . . . 42.4 mt-30 -148.79 164.09 35.44 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 126.981 2.112 . . . . 0.0 110.938 -176.307 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 606' ' ' ASN . . . . . . . . . . . . . 18.4 m120 55.71 43.87 27.25 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 125.271 1.428 . . . . 0.0 113.202 178.562 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 607' ' ' SER . . . . . . . . . . . . . 12.8 m -68.75 -9.84 53.04 Favored 'General case' 0 N--CA 1.478 0.942 0 N-CA-C 115.775 1.769 . . . . 0.0 115.775 -170.658 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 608' ' ' SER . . . . . . . . . . . . . 38.4 m . . . . . 0 C--O 1.252 1.232 0 C-N-CA 126.506 1.922 . . . . 0.0 114.073 -176.841 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 533' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.521 0 N-CA-C 111.063 -0.815 . . . . 0.0 111.063 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . -84.52 -25.83 41.39 Favored Glycine 0 CA--C 1.538 1.486 0 C-N-CA 124.42 1.01 . . . . 0.0 115.286 -178.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 535' ' ' SER . . . . . . . . . . . . . 94.6 p -157.0 0.83 0.12 Allowed 'General case' 0 N--CA 1.483 1.186 0 N-CA-C 115.575 1.694 . . . . 0.0 115.575 -174.499 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 536' ' ' GLU . . . . . . . . . . . . . 54.3 mp0 -69.28 -20.57 63.91 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.241 1.416 . . . . 0.0 113.759 -175.667 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 537' ' ' PHE . . . . . . . . . . . . . 81.0 m-85 -133.57 139.07 46.34 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.837 1.655 . . . . 0.0 111.446 -177.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 94.7 p -163.85 -162.64 0.72 Allowed 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 126.054 1.742 . . . . 0.0 110.099 -174.291 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 539' ' ' ASP . . . . . . . . . . . . . 66.6 m-20 -68.6 1.34 3.23 Favored 'General case' 0 CA--C 1.554 1.102 0 N-CA-C 114.167 1.173 . . . . 0.0 114.167 169.771 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 540' ' ' ARG . . . . . . . . . . . . . 52.6 ptt85 -56.52 155.88 6.77 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 125.611 1.565 . . . . 0.0 114.214 176.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 94.3 p -81.09 170.45 16.17 Favored 'General case' 0 C--O 1.24 0.596 0 C-N-CA 124.532 1.133 . . . . 0.0 111.794 169.114 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 542' ' ' ASN . . . . . . . . . . . . . 76.6 m-20 -87.1 -3.55 59.08 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 124.15 0.98 . . . . 0.0 113.052 169.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -62.33 -27.96 69.41 Favored 'General case' 0 N--CA 1.478 0.958 0 O-C-N 120.63 -1.294 . . . . 0.0 113.181 -174.211 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 80.5 mt -62.44 -29.45 70.52 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.665 1.186 . . . . 0.0 112.443 175.637 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 56.7 mt-10 -80.95 -19.33 44.41 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.556 1.143 . . . . 0.0 112.591 -177.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 14.6 mm -67.26 -31.93 55.26 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 C-N-CA 124.403 1.081 . . . . 0.0 111.232 176.721 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 39.3 mmt180 -58.19 -25.5 61.64 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 124.24 1.016 . . . . 0.0 112.799 171.856 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -79.88 -7.62 88.36 Favored Glycine 0 CA--C 1.536 1.394 0 C-N-CA 125.966 1.746 . . . . 0.0 115.013 -179.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 8.9 mmpt? -66.7 147.02 53.83 Favored 'General case' 0 N--CA 1.482 1.131 0 CA-C-N 119.811 1.805 . . . . 0.0 111.091 171.793 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 52.5 p90 -151.51 162.46 40.92 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.549 0.739 . . . . 0.0 112.787 171.193 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 1.6 m -130.44 134.69 61.94 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.926 0 C-N-CA 125.853 1.661 . . . . 0.0 109.74 173.075 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 10.0 p -67.8 138.01 23.5 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 O-C-N 121.616 -0.678 . . . . 0.0 111.731 -175.75 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 57.6 t -87.94 112.09 46.87 Favored Pre-proline 0 CA--C 1.544 0.744 0 C-N-CA 125.459 1.504 . . . . 0.0 108.941 170.19 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 67.5 Cg_endo -76.66 156.33 35.67 Favored 'Trans proline' 0 C--N 1.348 0.525 0 C-N-CA 122.62 2.213 . . . . 0.0 111.664 176.045 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 46.7 tt0 -58.02 -33.49 69.01 Favored 'General case' 0 CA--C 1.54 0.59 0 O-C-N 121.331 -0.856 . . . . 0.0 112.282 174.125 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 15.2 m -59.04 -25.98 64.18 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 125.463 1.505 . . . . 0.0 113.719 175.299 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 10.0 t -69.12 -23.61 64.0 Favored 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 113.092 0.775 . . . . 0.0 113.092 177.229 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 30.5 mt-30 59.35 -62.37 0.05 OUTLIER 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 129.211 3.005 . . . . 0.0 115.915 176.251 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 65.9 m-20 -82.21 -14.14 56.03 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 125.733 1.613 . . . . 0.0 113.374 -175.804 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 11.1 mtt 56.96 25.68 10.91 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 126.398 1.879 . . . . 0.0 114.976 179.582 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -131.42 144.75 51.42 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.265 1.026 . . . . 0.0 113.265 -171.748 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 4.5 t80 -153.84 -178.45 7.06 Favored 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 125.899 1.68 . . . . 0.0 109.668 173.131 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 5.2 tmmm? -137.05 134.17 36.25 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 125.027 1.331 . . . . 0.0 112.635 -178.695 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 30.9 t -69.55 117.17 50.4 Favored Pre-proline 0 CA--C 1.543 0.707 0 C-N-CA 126.681 1.993 . . . . 0.0 111.007 174.086 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_exo -65.11 -26.59 57.56 Favored 'Trans proline' 0 CA--C 1.542 0.885 0 C-N-CA 123.047 2.498 . . . . 0.0 114.646 175.739 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 80.6 mt -71.52 -57.46 7.44 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 C-N-CA 124.622 1.169 . . . . 0.0 111.418 -173.325 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 16.9 p -98.54 -1.86 40.1 Favored 'General case' 0 CA--C 1.549 0.932 0 N-CA-C 113.61 0.967 . . . . 0.0 113.61 179.276 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 568' ' ' LYS . . . . . . . . . . . . . 95.7 mttt 60.35 46.7 9.73 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 126.621 1.968 . . . . 0.0 112.778 -177.781 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 73.2 mm-40 -125.85 139.08 53.78 Favored 'General case' 0 N--CA 1.483 1.176 0 N-CA-C 115.481 1.66 . . . . 0.0 115.481 -174.24 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 24.4 m -69.66 138.51 53.07 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.734 1.214 . . . . 0.0 113.127 -179.109 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -112.73 140.07 34.5 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 C-N-CA 126.639 1.976 . . . . 0.0 109.904 167.841 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 44.4 p -130.42 144.03 51.14 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 125.377 1.471 . . . . 0.0 110.961 178.452 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -65.95 144.27 46.3 Favored Glycine 0 CA--C 1.53 1.006 0 C-N-CA 123.773 0.701 . . . . 0.0 114.093 -179.118 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 19.2 m -128.92 149.22 33.43 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 C-N-CA 125.68 1.592 . . . . 0.0 111.742 174.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 62.8 t80 -74.25 140.42 44.99 Favored 'General case' 0 CA--C 1.542 0.663 0 O-C-N 121.311 -0.868 . . . . 0.0 113.08 -175.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 21.1 t0 -115.81 118.53 33.28 Favored 'General case' 0 C--O 1.236 0.342 0 C-N-CA 126.776 2.031 . . . . 0.0 110.82 171.186 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 23.6 mp0 -74.27 -25.97 59.92 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 124.183 0.993 . . . . 0.0 113.383 -177.389 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 37.2 tp10 -74.48 -49.13 23.44 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 124.421 1.088 . . . . 0.0 112.195 -179.459 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 20.5 m -77.18 -31.71 55.6 Favored 'General case' 0 N--CA 1.476 0.833 0 O-C-N 121.739 -0.601 . . . . 0.0 111.924 172.637 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 76.38 30.48 56.7 Favored Glycine 0 CA--C 1.535 1.309 0 C-N-CA 123.506 0.574 . . . . 0.0 111.878 -170.11 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 79.9 mm-40 -130.95 175.92 8.67 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 126.253 1.821 . . . . 0.0 111.085 -174.166 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 62.4 m95 -100.15 149.77 23.19 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 123.969 0.908 . . . . 0.0 111.026 172.306 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 13.0 m -140.84 147.05 23.14 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 C-N-CA 125.94 1.696 . . . . 0.0 112.871 -172.311 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 4.1 m0 -97.64 106.64 18.99 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 125.905 1.682 . . . . 0.0 107.891 169.057 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 42.8 mtmt -81.96 153.22 26.37 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 124.133 0.973 . . . . 0.0 112.282 -179.456 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 54.25 33.65 18.66 Favored 'General case' 0 CA--C 1.554 1.101 0 C-N-CA 125.646 1.578 . . . . 0.0 111.601 -174.825 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 65.5 m -130.03 150.86 51.12 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 125.307 1.443 . . . . 0.0 112.293 -169.407 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 9.9 tt -140.24 146.32 24.82 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.653 0 C-N-CA 128.508 2.723 . . . . 0.0 110.108 -179.667 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 67.3 tt0 -113.77 132.87 55.69 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 125.35 1.46 . . . . 0.0 110.689 170.272 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 9.4 p -157.19 143.71 9.71 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 C-N-CA 124.479 1.112 . . . . 0.0 111.411 176.378 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 9.4 t-20 52.78 32.9 13.0 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 125.285 1.434 . . . . 0.0 114.421 178.223 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 76.05 9.76 85.33 Favored Glycine 0 CA--C 1.538 1.489 0 C-N-CA 124.698 1.142 . . . . 0.0 115.563 -177.511 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 99.6 mttt -122.13 152.45 39.88 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 126.013 1.725 . . . . 0.0 111.493 -179.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 79.0 m-85 -98.65 150.62 21.57 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 124.084 0.954 . . . . 0.0 112.751 170.304 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 93.4 m-85 -151.44 161.51 42.56 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 125.959 1.704 . . . . 0.0 110.1 -179.681 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 596' ' ' HIS . . . . . . . . . . . . . 28.6 m80 -75.71 141.89 42.58 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 167.027 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 50.3 p -61.26 -42.71 99.1 Favored 'General case' 0 N--CA 1.47 0.525 0 C-N-CA 123.592 0.757 . . . . 0.0 112.214 -179.321 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 2.7 p -68.35 -42.0 79.85 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 124.42 1.088 . . . . 0.0 112.791 175.457 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 599' ' ' CYS . . . . . . . . . . . . . 69.4 m -58.68 -59.2 5.79 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.192 0.997 . . . . 0.0 110.894 175.068 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 79.2 t80 -57.76 -43.25 85.35 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.375 1.07 . . . . 0.0 112.648 -177.912 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 82.5 t60 -58.13 -39.49 78.85 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 179.855 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 37.9 tp10 -90.45 -25.26 20.43 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 114.241 1.2 . . . . 0.0 114.241 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 28.3 m -110.04 -26.11 9.88 Favored 'General case' 0 N--CA 1.482 1.164 0 N-CA-C 115.766 1.765 . . . . 0.0 115.766 -166.924 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 604' ' ' SER . . . . . . . . . . . . . 71.2 p -56.23 -72.09 0.08 Allowed 'General case' 0 N--CA 1.481 1.098 0 N-CA-C 115.134 1.531 . . . . 0.0 115.134 -168.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 605' ' ' GLN . . . . . . . . . . . . . 37.0 tt0 40.66 -88.93 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 128.532 2.733 . . . . 0.0 116.2 178.689 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 606' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -149.51 147.9 28.75 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 126.281 1.833 . . . . 0.0 112.143 -176.423 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 607' ' ' SER . . . . . . . . . . . . . 33.3 t -73.03 -35.79 66.82 Favored 'General case' 0 N--CA 1.479 0.982 0 N-CA-C 113.349 0.87 . . . . 0.0 113.349 176.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 608' ' ' SER . . . . . . . . . . . . . 64.6 p . . . . . 0 C--O 1.252 1.235 0 C-N-CA 126.285 1.834 . . . . 0.0 113.252 -177.7 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 533' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.614 0 N-CA-C 111.458 -0.657 . . . . 0.0 111.458 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 81.83 23.52 57.55 Favored Glycine 0 CA--C 1.537 1.454 0 C-N-CA 123.977 0.798 . . . . 0.0 113.258 -172.36 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 535' ' ' SER . . . . . . . . . . . . . 79.5 p -145.75 4.29 0.99 Allowed 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 126.119 1.768 . . . . 0.0 113.945 -171.186 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 536' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -64.89 176.29 1.26 Allowed 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 126.311 1.844 . . . . 0.0 113.2 173.095 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 537' ' ' PHE . . . . . . . . . . . . . 40.8 p90 -61.99 -26.95 68.53 Favored 'General case' 0 CA--C 1.546 0.806 0 N-CA-C 113.973 1.101 . . . . 0.0 113.973 177.737 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 65.3 p -78.86 157.81 28.24 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 125.497 1.519 . . . . 0.0 112.913 177.803 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 539' ' ' ASP . . . . . . . . . . . . . 63.8 m-20 -77.65 56.93 1.53 Allowed 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 125.379 1.472 . . . . 0.0 113.732 -173.472 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 540' ' ' ARG . . . . . . . . . . . . . 55.4 mtp180 -72.16 28.42 0.05 Allowed 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 126.322 1.849 . . . . 0.0 114.733 178.914 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 20.8 t -73.62 -175.0 1.88 Allowed 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 125.552 1.541 . . . . 0.0 111.31 170.928 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 542' ' ' ASN . . . . . . . . . . . . . 76.2 m-20 -55.38 -21.84 17.16 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.017 1.327 . . . . 0.0 113.71 176.22 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 85.7 mt-10 -56.12 -26.76 51.32 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 125.08 1.352 . . . . 0.0 113.465 172.154 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 50.2 tp -69.56 -31.6 69.88 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 123.997 0.919 . . . . 0.0 112.689 175.04 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 69.3 mm-40 -75.51 -24.7 56.87 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.468 1.107 . . . . 0.0 112.824 177.728 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 22.7 mm -58.12 -37.02 59.65 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.829 0 C-N-CA 124.391 1.077 . . . . 0.0 111.45 177.513 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 30.7 mmm-85 -64.59 -29.93 70.95 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.739 1.216 . . . . 0.0 112.693 178.564 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -82.54 -7.29 87.7 Favored Glycine 0 CA--C 1.535 1.282 0 C-N-CA 125.056 1.312 . . . . 0.0 115.133 179.9 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -69.99 145.85 51.51 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 118.904 1.352 . . . . 0.0 111.829 176.806 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 38.6 p90 -153.39 166.92 31.15 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 125.032 1.333 . . . . 0.0 112.773 175.296 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 2.4 m -131.1 138.72 52.75 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.5 0 C-N-CA 125.733 1.613 . . . . 0.0 110.136 169.774 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 9.9 p -69.36 136.41 26.32 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 O-C-N 121.319 -0.863 . . . . 0.0 111.623 -176.993 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 51.1 t -76.31 123.89 88.0 Favored Pre-proline 0 CA--C 1.543 0.706 0 C-N-CA 124.805 1.242 . . . . 0.0 109.586 177.352 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -74.9 150.2 38.33 Favored 'Trans proline' 0 CA--C 1.543 0.939 0 C-N-CA 122.993 2.462 . . . . 0.0 111.028 175.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 50.3 mt-10 -65.09 -19.29 65.92 Favored 'General case' 0 CA--C 1.549 0.926 0 N-CA-C 113.479 0.918 . . . . 0.0 113.479 177.723 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 68.2 p -68.71 -24.92 64.54 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 124.216 1.006 . . . . 0.0 113.153 170.334 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 17.5 t -79.36 76.55 5.93 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-O 122.371 1.081 . . . . 0.0 110.299 169.791 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 62.6 tt0 -60.33 -34.45 73.84 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.356 1.062 . . . . 0.0 112.956 -174.496 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 69.4 m-20 -87.51 -6.59 58.3 Favored 'General case' 0 CA--C 1.551 0.981 0 C-N-CA 124.954 1.302 . . . . 0.0 113.74 175.114 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 9.0 mtt 52.24 38.44 24.66 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 126.785 2.034 . . . . 0.0 114.188 -178.116 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -128.26 143.43 51.03 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 114.244 1.201 . . . . 0.0 114.244 -173.168 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -143.36 176.54 9.08 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 126.487 1.915 . . . . 0.0 109.322 172.826 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 563' ' ' LYS . . . . . . . . . . . . 0.255 0.0 OUTLIER -141.76 148.16 38.52 Favored 'General case' 0 N--CA 1.477 0.888 0 N-CA-C 114.767 1.395 . . . . 0.0 114.767 175.891 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 12.0 t -79.32 116.85 63.49 Favored Pre-proline 0 CA--C 1.542 0.636 0 C-N-CA 126.765 2.026 . . . . 0.0 111.006 173.451 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_endo -72.51 -18.15 26.12 Favored 'Trans proline' 0 CA--C 1.545 1.073 0 C-N-CA 122.719 2.279 . . . . 0.0 113.612 174.782 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 90.7 mt -71.49 -55.22 14.47 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.9 0 C-N-CA 124.514 1.125 . . . . 0.0 110.747 -178.442 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 13.9 p -103.61 2.52 33.42 Favored 'General case' 0 CA--C 1.552 1.028 0 N-CA-C 114.137 1.162 . . . . 0.0 114.137 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 568' ' ' LYS . . . . . . . . . . . . 0.308 11.9 ptmm? 54.52 46.61 24.52 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 127.04 2.136 . . . . 0.0 113.82 -177.045 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 69.2 mm-40 -124.81 143.33 50.87 Favored 'General case' 0 N--CA 1.482 1.143 0 N-CA-C 114.835 1.42 . . . . 0.0 114.835 -176.108 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 73.9 m -78.06 145.66 35.72 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 124.241 1.017 . . . . 0.0 112.749 -178.589 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -119.61 131.7 71.43 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.892 0 C-N-CA 127.014 2.126 . . . . 0.0 109.752 168.305 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 38.9 p -111.86 147.02 36.67 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 125.064 1.345 . . . . 0.0 111.753 178.277 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -71.02 147.57 43.16 Favored Glycine 0 CA--C 1.532 1.101 0 C-N-CA 124.933 1.254 . . . . 0.0 113.743 178.621 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 60.9 t -139.47 132.49 36.93 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 C-N-CA 124.56 1.144 . . . . 0.0 111.083 -176.465 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 68.5 t80 -70.12 112.1 6.24 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 118.706 0.684 . . . . 0.0 111.522 179.478 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 23.2 t0 -81.8 112.02 18.57 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 123.331 0.653 . . . . 0.0 109.559 169.39 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 53.6 mt-10 -69.43 -19.31 63.79 Favored 'General case' 0 CA--C 1.546 0.812 0 N-CA-C 113.913 1.079 . . . . 0.0 113.913 178.836 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 33.2 tp10 -77.38 -51.41 10.86 Favored 'General case' 0 CA--C 1.543 0.71 0 O-C-N 121.366 -0.834 . . . . 0.0 112.811 178.898 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 32.2 t -76.06 -33.42 59.58 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 124.309 1.044 . . . . 0.0 112.686 172.318 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 86.09 31.18 20.84 Favored Glycine 0 CA--C 1.531 1.064 0 C-N-CA 125.038 1.304 . . . . 0.0 113.63 -176.761 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 74.1 mm-40 -142.31 151.66 42.19 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 125.504 1.522 . . . . 0.0 111.825 -172.459 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 82.5 m95 -75.84 134.4 40.36 Favored 'General case' 0 N--CA 1.468 0.437 0 O-C-N 121.653 -0.654 . . . . 0.0 111.7 172.521 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 17.0 m -135.05 143.0 38.5 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.559 0 C-N-CA 125.414 1.486 . . . . 0.0 113.327 -171.844 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 3.7 m0 -91.03 100.95 13.72 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 126.287 1.835 . . . . 0.0 107.857 169.288 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -73.98 153.85 39.56 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 124.169 0.988 . . . . 0.0 111.66 -179.68 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 54.63 36.75 26.76 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 125.03 1.332 . . . . 0.0 112.047 179.409 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 85.0 m -129.83 148.19 51.68 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 125.173 1.389 . . . . 0.0 112.113 -170.328 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 15.4 tt -145.84 146.3 19.46 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 C-N-CA 126.912 2.085 . . . . 0.0 111.503 -178.388 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 8.9 tm-20 -107.54 145.6 32.94 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.852 1.261 . . . . 0.0 111.172 166.343 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 1.2 t -159.32 144.58 6.56 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 C-N-CA 126.196 1.798 . . . . 0.0 109.765 171.589 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 10.6 t-20 54.99 29.87 13.09 Favored 'General case' 0 CA--C 1.554 1.133 0 N-CA-C 114.17 1.174 . . . . 0.0 114.17 175.036 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 76.73 14.06 82.91 Favored Glycine 0 CA--C 1.535 1.284 0 C-N-CA 124.618 1.104 . . . . 0.0 115.066 -176.45 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 51.1 mttp -131.31 146.83 52.46 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 126.088 1.755 . . . . 0.0 110.873 -171.337 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 57.4 m-85 -102.35 147.85 26.2 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 123.857 0.863 . . . . 0.0 112.838 -178.329 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 89.8 m-85 -153.19 164.46 38.02 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.914 1.686 . . . . 0.0 111.574 -169.879 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 596' ' ' HIS . . . . . . . . . . . . . 17.6 m80 -77.83 140.72 39.4 Favored 'General case' 0 N--CA 1.473 0.694 0 O-C-N 121.023 -1.048 . . . . 0.0 108.706 166.204 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 78.3 p -58.4 -42.24 86.69 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 123.657 0.783 . . . . 0.0 112.234 178.304 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 22.8 p -67.92 -47.71 67.99 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 125.533 1.533 . . . . 0.0 113.213 174.854 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 599' ' ' CYS . . . . . . . . . . . . . 86.4 m -60.65 -50.63 72.75 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 123.436 0.694 . . . . 0.0 111.493 179.732 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 88.2 t80 -56.07 -45.22 79.39 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 123.291 0.637 . . . . 0.0 112.135 178.227 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 22.7 t-160 -63.67 -46.56 84.99 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 112.939 0.718 . . . . 0.0 112.939 177.736 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 14.9 tm-20 -70.42 -33.4 71.3 Favored 'General case' 0 CA--C 1.543 0.702 0 O-C-N 121.502 -0.749 . . . . 0.0 112.649 -179.642 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 96.0 m -74.7 -37.53 62.59 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.619 1.168 . . . . 0.0 112.06 177.823 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 604' ' ' SER . . . . . . . . . . . . . 38.0 m -78.06 58.95 2.09 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 125.247 1.419 . . . . 0.0 111.5 174.814 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 605' ' ' GLN . . . . . . . . . . . . . 2.8 pt20 -70.4 75.48 0.55 Allowed 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 126.233 1.813 . . . . 0.0 113.817 -170.318 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 606' ' ' ASN . . . . . . . . . . . . . 65.4 m-20 58.5 31.4 20.97 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 126.529 1.932 . . . . 0.0 114.283 177.231 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 607' ' ' SER . . . . . . . . . . . . . 65.1 p -67.49 154.24 41.85 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 124.904 1.281 . . . . 0.0 113.073 175.056 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 608' ' ' SER . . . . . . . . . . . . . 21.1 t . . . . . 0 C--O 1.253 1.285 0 C-N-CA 125.662 1.585 . . . . 0.0 112.936 -179.255 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 533' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.551 0 N-CA-C 111.842 -0.503 . . . . 0.0 111.842 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 173.82 -162.95 33.88 Favored Glycine 0 CA--C 1.535 1.305 0 C-N-CA 124.71 1.147 . . . . 0.0 113.604 179.485 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 535' ' ' SER . . . . . . . . . . . . . 77.2 p -69.92 174.85 4.84 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.846 1.258 . . . . 0.0 112.62 170.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 536' ' ' GLU . . . . . . . . . . . . . 15.0 mp0 -68.24 136.39 53.46 Favored 'General case' 0 CA--C 1.547 0.852 0 O-C-N 120.887 -1.133 . . . . 0.0 113.096 -179.563 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 537' ' ' PHE . . . . . . . . . . . . . 75.7 m-85 -133.61 16.4 3.98 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 125.449 1.5 . . . . 0.0 113.262 177.021 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 88.8 p -153.49 163.73 39.45 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 124.767 1.227 . . . . 0.0 113.288 -172.234 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 539' ' ' ASP . . . . . . . . . . . . . 31.7 m-20 -131.39 149.46 52.53 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 126.948 2.099 . . . . 0.0 109.986 173.027 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 540' ' ' ARG . . . . . . . . . . . . . 13.3 tpt180 -78.3 52.29 1.11 Allowed 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 124.407 1.083 . . . . 0.0 112.801 -178.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 49.7 m -68.94 136.2 52.17 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 124.869 1.268 . . . . 0.0 111.282 174.728 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 542' ' ' ASN . . . . . . . . . . . . . 13.3 p-10 -60.58 -26.4 66.92 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 123.955 0.902 . . . . 0.0 113.372 -177.74 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 76.2 mt-10 -62.08 -30.52 71.06 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 125.103 1.361 . . . . 0.0 113.137 176.951 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 63.2 mt -82.03 -26.46 33.76 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.125 0.97 . . . . 0.0 112.274 179.087 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -65.77 -26.43 67.71 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 124.539 1.136 . . . . 0.0 112.51 -179.874 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 14.1 mm -54.43 -34.97 29.64 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 C-N-CA 126.057 1.743 . . . . 0.0 112.451 -177.545 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 32.8 ttm180 -61.33 -21.48 64.04 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 125.158 1.383 . . . . 0.0 113.924 178.051 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -71.85 -12.74 75.04 Favored Glycine 0 CA--C 1.539 1.566 0 N-CA-C 115.289 0.876 . . . . 0.0 115.289 177.271 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -70.96 147.91 48.22 Favored 'General case' 0 N--CA 1.478 0.944 0 CA-C-N 118.965 1.383 . . . . 0.0 112.129 177.844 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 46.8 p90 -152.59 165.81 34.01 Favored 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 114.008 1.114 . . . . 0.0 114.008 176.127 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 1.1 m -135.67 139.5 46.22 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.035 0 C-N-CA 126.757 2.023 . . . . 0.0 110.484 174.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 55.5 t -69.71 133.09 32.46 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.298 0 O-C-N 120.889 -1.132 . . . . 0.0 111.662 -176.021 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 95.0 t -69.37 124.17 89.91 Favored Pre-proline 0 N--CA 1.476 0.837 0 C-N-CA 124.725 1.21 . . . . 0.0 109.035 170.263 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 93.7 Cg_endo -78.35 143.48 19.68 Favored 'Trans proline' 0 CA--C 1.536 0.596 0 C-N-CA 123.152 2.568 . . . . 0.0 111.977 174.477 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -61.55 -24.76 66.86 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.08 0.952 . . . . 0.0 113.248 -179.559 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 58.6 p -72.18 -26.45 62.07 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 124.7 1.2 . . . . 0.0 113.523 177.207 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 39.7 m -80.85 88.94 5.82 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-N 119.336 0.971 . . . . 0.0 110.829 175.01 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 83.4 mt-30 -56.1 -30.97 62.82 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.205 1.402 . . . . 0.0 113.984 -176.694 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 69.4 m-20 -76.87 -21.73 54.51 Favored 'General case' 0 CA--C 1.545 0.784 0 N-CA-C 113.859 1.059 . . . . 0.0 113.859 178.257 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 66.8 mtp 51.3 32.67 8.62 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 126.105 1.762 . . . . 0.0 113.27 -173.488 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -147.97 154.12 39.91 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 124.691 1.196 . . . . 0.0 113.035 -170.346 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 6.9 t80 -153.94 155.64 36.0 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 124.922 1.289 . . . . 0.0 110.502 173.164 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 3.2 tmmm? -106.58 115.4 30.14 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 125.171 1.388 . . . . 0.0 111.985 -173.695 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 35.5 t -54.37 111.38 2.84 Favored Pre-proline 0 CA--C 1.545 0.768 0 C-N-CA 127.596 2.358 . . . . 0.0 111.279 174.876 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -62.74 -21.52 73.08 Favored 'Trans proline' 0 CA--C 1.539 0.755 0 C-N-CA 123.018 2.478 . . . . 0.0 114.957 178.894 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 96.7 mt -74.54 -57.56 6.34 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 C-N-CA 123.965 0.906 . . . . 0.0 111.164 -176.653 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 16.7 p -102.48 -0.94 31.54 Favored 'General case' 0 CA--C 1.551 0.986 0 N-CA-C 113.784 1.031 . . . . 0.0 113.784 -176.76 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 568' ' ' LYS . . . . . . . . . . . . . 32.9 mmtp 61.27 46.4 7.9 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 127.201 2.2 . . . . 0.0 112.985 -176.795 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 75.7 mt-10 -122.3 136.02 54.83 Favored 'General case' 0 N--CA 1.487 1.405 0 N-CA-C 114.737 1.384 . . . . 0.0 114.737 -173.916 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 79.2 m -83.49 116.85 22.73 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 112.896 0.702 . . . . 0.0 112.896 -179.016 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -85.27 147.56 5.43 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 C-N-CA 124.74 1.216 . . . . 0.0 110.116 167.068 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 58.4 p -133.32 151.37 51.87 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 125.636 1.574 . . . . 0.0 111.25 -179.37 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -70.15 158.53 53.5 Favored Glycine 0 CA--C 1.535 1.327 0 N-CA-C 114.965 0.746 . . . . 0.0 114.965 -176.034 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 9.2 p -140.52 143.37 29.26 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 125.099 1.36 . . . . 0.0 111.763 170.128 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 9.2 t80 -75.07 127.13 32.51 Favored 'General case' 0 CA--C 1.549 0.932 0 N-CA-C 113.905 1.076 . . . . 0.0 113.905 -173.922 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 37.7 t0 -97.85 101.19 12.63 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 125.812 1.645 . . . . 0.0 109.494 168.638 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -63.89 -26.61 68.68 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 124.651 1.181 . . . . 0.0 113.454 -179.194 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 73.2 mm-40 -78.03 -46.06 21.97 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 123.664 0.786 . . . . 0.0 112.468 -178.152 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 71.2 m -77.62 -29.36 51.76 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 123.446 0.698 . . . . 0.0 112.33 173.212 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 81.46 26.82 50.12 Favored Glycine 0 CA--C 1.534 1.257 0 C-N-CA 123.957 0.789 . . . . 0.0 112.963 -175.375 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 79.6 mm-40 -137.68 161.18 37.17 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 126.345 1.858 . . . . 0.0 110.148 -173.034 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 32.6 m95 -96.35 150.26 20.77 Favored 'General case' 0 CA--C 1.54 0.59 0 O-C-N 120.941 -1.1 . . . . 0.0 111.569 175.795 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 9.9 m -135.6 144.9 32.54 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 C-N-CA 125.299 1.44 . . . . 0.0 113.115 -173.686 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 3.2 m0 -92.0 104.86 17.22 Favored 'General case' 0 C--O 1.234 0.276 0 C-N-CA 126.67 1.988 . . . . 0.0 109.411 170.035 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -73.76 152.53 40.32 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 124.679 1.192 . . . . 0.0 112.104 178.421 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 54.73 29.86 12.49 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 125.519 1.527 . . . . 0.0 112.433 -177.662 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 62.0 m -125.05 149.22 48.01 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 124.517 1.127 . . . . 0.0 112.797 -169.303 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 14.9 tt -136.14 145.48 30.83 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.585 0 C-N-CA 127.906 2.482 . . . . 0.0 110.373 177.516 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 71.3 tt0 -107.77 123.48 48.61 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.659 1.184 . . . . 0.0 109.618 169.723 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 7.6 p -157.56 146.27 10.12 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 C-N-CA 124.774 1.23 . . . . 0.0 110.518 -177.028 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 8.2 t-20 52.88 35.19 18.36 Favored 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 124.642 1.177 . . . . 0.0 112.894 -175.649 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 68.67 14.39 67.29 Favored Glycine 0 CA--C 1.536 1.35 0 C-N-CA 125.5 1.524 . . . . 0.0 115.661 -178.291 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 35.9 mtmm -133.31 156.89 46.77 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 125.937 1.695 . . . . 0.0 111.456 -175.671 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 85.8 m-85 -90.74 147.26 23.36 Favored 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 113.001 0.741 . . . . 0.0 113.001 172.588 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 78.4 m-85 -150.44 160.72 43.56 Favored 'General case' 0 C--N 1.329 -0.326 0 C-N-CA 126.235 1.814 . . . . 0.0 110.043 -175.612 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 596' ' ' HIS . . . . . . . . . . . . . 26.0 m80 -75.2 139.08 42.4 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 108.486 -0.931 . . . . 0.0 108.486 167.136 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 59.2 p -59.91 -40.16 87.86 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.634 0.774 . . . . 0.0 111.812 177.653 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 9.4 p -71.25 -36.83 71.92 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 125.693 1.597 . . . . 0.0 113.113 176.72 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 599' ' ' CYS . . . . . . . . . . . . . 69.2 m -64.75 -59.48 4.18 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.353 1.061 . . . . 0.0 111.186 174.795 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 61.7 t80 -53.3 -41.51 65.7 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.363 1.065 . . . . 0.0 113.069 -177.179 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 83.2 t60 -61.4 -34.2 74.95 Favored 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 114.879 1.437 . . . . 0.0 114.879 -177.476 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 35.1 tp10 -102.22 -18.75 15.36 Favored 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 114.196 1.184 . . . . 0.0 114.196 -176.277 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 50.1 m -77.34 -32.01 54.85 Favored 'General case' 0 N--CA 1.481 1.09 0 N-CA-C 115.993 1.849 . . . . 0.0 115.993 -167.977 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 604' ' ' SER . . . . . . . . . . . . . 26.6 t -64.48 123.17 18.53 Favored 'General case' 0 N--CA 1.477 0.918 0 CA-C-N 119.789 1.177 . . . . 0.0 113.186 -173.103 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 605' ' ' GLN . . . . . . . . . . . . . 66.2 mt-30 -97.96 -27.37 14.28 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 124.58 1.152 . . . . 0.0 113.671 -178.251 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 606' ' ' ASN . . . . . . . . . . . . . 14.9 t-20 -83.88 171.18 13.31 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 124.789 1.236 . . . . 0.0 112.459 -174.242 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 607' ' ' SER . . . . . . . . . . . . . 19.3 m 59.25 34.19 22.95 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 125.693 1.597 . . . . 0.0 114.063 176.413 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 608' ' ' SER . . . . . . . . . . . . . 22.8 t . . . . . 0 C--O 1.254 1.317 0 C-N-CA 125.453 1.501 . . . . 0.0 112.551 176.624 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 533' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.626 0 N-CA-C 112.241 -0.344 . . . . 0.0 112.241 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 80.57 4.42 90.15 Favored Glycine 0 CA--C 1.539 1.578 0 C-N-CA 124.788 1.185 . . . . 0.0 115.649 179.14 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 535' ' ' SER . . . . . . . . . . . . . 26.7 m -76.1 58.4 1.21 Allowed 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 126.279 1.831 . . . . 0.0 112.339 179.05 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 536' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -143.36 153.75 43.03 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 125.198 1.399 . . . . 0.0 112.562 -173.125 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 537' ' ' PHE . . . . . . . . . . . . . 86.1 m-85 -75.99 153.2 36.7 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.389 1.076 . . . . 0.0 112.944 178.921 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 14.1 t -158.59 -174.92 5.02 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 126.027 1.731 . . . . 0.0 110.751 -178.599 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 539' ' ' ASP . . . . . . . . . . . . . 68.8 m-20 -70.53 3.11 3.28 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 125.583 1.553 . . . . 0.0 114.194 174.771 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 540' ' ' ARG . . . . . . . . . . . . . 3.1 ttp180 -70.79 66.05 0.35 Allowed 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 127.435 2.294 . . . . 0.0 113.056 179.258 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 17.0 t -74.23 -145.72 0.02 OUTLIER 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 125.97 1.708 . . . . 0.0 110.865 170.618 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 542' ' ' ASN . . . . . . . . . . . . . 40.2 p-10 -65.28 11.53 0.06 Allowed 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 126.082 1.753 . . . . 0.0 115.409 174.031 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 8.9 mm-40 -51.22 -41.33 60.22 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 126.37 1.868 . . . . 0.0 112.75 179.448 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 11.0 mp -62.15 -33.81 75.2 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 124.152 0.981 . . . . 0.0 111.86 179.032 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 32.6 tp10 -82.6 -36.67 25.95 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 123.541 0.736 . . . . 0.0 112.689 179.929 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 30.0 mm -64.86 -41.61 92.62 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 C-N-CA 123.349 0.66 . . . . 0.0 110.891 172.256 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 71.4 mtp180 -85.68 -20.8 28.84 Favored 'General case' 0 N--CA 1.481 1.1 0 N-CA-C 113.389 0.885 . . . . 0.0 113.389 -175.279 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -72.63 -10.97 76.92 Favored Glycine 0 CA--C 1.54 1.626 0 C-N-CA 125.467 1.508 . . . . 0.0 114.466 171.686 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 70.1 mmtt -66.34 140.12 58.07 Favored 'General case' 0 N--CA 1.477 0.918 0 CA-C-N 119.089 1.444 . . . . 0.0 111.747 173.271 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 46.1 p90 -153.79 164.86 37.64 Favored 'General case' 0 C--O 1.238 0.467 0 C-N-CA 124.253 1.021 . . . . 0.0 111.723 169.613 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -134.37 135.33 54.21 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 C-N-CA 125.563 1.545 . . . . 0.0 109.736 175.045 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 53.9 t -67.95 133.07 32.21 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.104 0 C-N-CA 123.741 0.816 . . . . 0.0 110.731 -177.349 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 5.3 t -84.92 116.17 64.21 Favored Pre-proline 0 CA--C 1.541 0.61 0 C-N-CA 124.117 0.967 . . . . 0.0 109.84 173.805 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -76.69 163.33 31.76 Favored 'Trans proline' 0 CA--C 1.536 0.623 0 C-N-CA 122.509 2.139 . . . . 0.0 112.162 176.887 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 39.8 mm-40 -62.38 -28.64 69.91 Favored 'General case' 0 CA--C 1.548 0.895 0 O-C-N 121.296 -0.878 . . . . 0.0 112.562 173.04 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 69.7 p -67.59 -18.0 64.84 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 125.038 1.335 . . . . 0.0 113.322 175.793 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 18.2 m -80.81 -0.6 39.46 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 114.335 1.235 . . . . 0.0 114.335 169.684 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 88.4 mt-30 45.36 -84.43 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 128.571 2.748 . . . . 0.0 116.621 169.268 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 71.1 m-20 -70.83 -9.35 57.35 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 125.446 1.498 . . . . 0.0 113.914 178.738 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 12.1 mtt 57.99 31.14 20.23 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 126.002 1.721 . . . . 0.0 115.043 178.024 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -122.56 141.84 51.25 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 124.024 0.93 . . . . 0.0 112.943 -177.401 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -149.59 157.84 43.62 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 124.979 1.312 . . . . 0.0 111.436 179.703 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 39.2 ttpt -104.11 144.95 30.88 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 124.795 1.238 . . . . 0.0 114.197 -170.553 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 12.2 t -100.63 107.21 47.64 Favored Pre-proline 0 CA--C 1.541 0.632 0 C-N-CA 126.833 2.053 . . . . 0.0 108.607 166.943 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo -69.96 -16.96 36.91 Favored 'Trans proline' 0 CA--C 1.546 1.097 0 C-N-CA 122.502 2.134 . . . . 0.0 113.443 177.53 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 87.6 mt -72.9 -57.78 6.3 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 C-N-CA 124.12 0.968 . . . . 0.0 111.13 -178.957 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 15.5 p -98.11 -1.93 41.22 Favored 'General case' 0 CA--C 1.552 1.022 0 N-CA-C 113.648 0.981 . . . . 0.0 113.648 179.697 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 568' ' ' LYS . . . . . . . . . . . . . 45.6 tttt 59.73 45.84 12.37 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 126.522 1.929 . . . . 0.0 112.705 -177.736 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 70.3 mm-40 -117.59 166.09 12.79 Favored 'General case' 0 N--CA 1.482 1.149 0 N-CA-C 112.83 0.678 . . . . 0.0 112.83 -178.688 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 89.7 m -112.2 118.53 35.57 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.972 0.909 . . . . 0.0 111.199 179.34 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 3.5 m -79.53 138.58 19.71 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 123.486 0.715 . . . . 0.0 110.26 167.721 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 41.4 p -120.99 142.56 49.67 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 124.818 1.247 . . . . 0.0 110.077 176.307 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -65.92 144.15 46.15 Favored Glycine 0 CA--C 1.533 1.18 0 O-C-N 122.067 -0.395 . . . . 0.0 112.804 178.788 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 86.4 t -129.24 131.95 67.25 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 C-N-CA 125.237 1.415 . . . . 0.0 110.938 -178.901 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 71.5 t80 -71.82 117.49 13.48 Favored 'General case' 0 CA--C 1.549 0.912 0 CA-C-N 118.622 0.647 . . . . 0.0 112.315 -178.395 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 39.7 t0 -84.45 111.01 19.09 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.534 1.134 . . . . 0.0 109.469 169.016 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 54.5 mt-10 -68.9 -24.16 64.28 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 113.672 0.99 . . . . 0.0 113.672 -179.22 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 61.0 mt-10 -77.32 -42.0 38.43 Favored 'General case' 0 N--CA 1.475 0.788 0 O-C-N 121.207 -0.933 . . . . 0.0 112.908 -176.166 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 96.8 p -91.34 -24.74 19.7 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.852 0.861 . . . . 0.0 113.092 172.366 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 82.05 32.16 29.94 Favored Glycine 0 CA--C 1.533 1.159 0 C-N-CA 124.228 0.918 . . . . 0.0 113.124 -178.61 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 61.4 mm-40 -134.49 149.55 50.71 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 125.189 1.396 . . . . 0.0 111.439 -173.881 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 78.4 m95 -79.62 141.7 36.28 Favored 'General case' 0 CA--C 1.535 0.402 0 O-C-N 121.22 -0.925 . . . . 0.0 111.257 171.668 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 21.1 m -137.01 143.85 33.74 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 C-N-CA 125.703 1.601 . . . . 0.0 113.124 -174.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 2.2 m0 -95.64 102.27 14.05 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 126.561 1.944 . . . . 0.0 107.739 170.37 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -79.32 148.75 31.98 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.873 1.269 . . . . 0.0 112.224 -176.873 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 61.0 t30 52.41 36.27 19.56 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.759 1.624 . . . . 0.0 112.805 -173.174 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 86.4 m -119.55 147.67 44.19 Favored 'General case' 0 N--CA 1.479 0.982 0 O-C-N 120.739 -1.226 . . . . 0.0 112.064 -172.589 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 8.9 tt -145.16 145.49 20.71 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.586 0 C-N-CA 127.312 2.245 . . . . 0.0 110.78 -177.123 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 63.0 tt0 -113.39 128.83 56.59 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.867 1.267 . . . . 0.0 109.417 168.009 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 7.5 p -152.52 135.9 7.8 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.832 0 C-N-CA 125.35 1.46 . . . . 0.0 110.636 -178.058 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 72.4 m-20 53.99 34.01 18.75 Favored 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 124.868 1.267 . . . . 0.0 113.756 -176.129 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 78.02 11.87 84.95 Favored Glycine 0 CA--C 1.537 1.465 0 C-N-CA 124.985 1.279 . . . . 0.0 115.484 -179.899 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -129.86 150.76 51.01 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 125.311 1.444 . . . . 0.0 111.559 -178.528 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 14.2 m-85 -93.48 147.21 23.18 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.611 1.165 . . . . 0.0 112.238 177.749 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 95.3 m-85 -154.08 165.08 37.31 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 126.027 1.731 . . . . 0.0 111.176 -177.248 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 596' ' ' HIS . . . . . . . . . . . . . 21.5 m80 -79.32 142.45 36.08 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 108.142 -1.058 . . . . 0.0 108.142 165.424 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 7.8 t -66.56 -39.06 88.33 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 118.997 0.817 . . . . 0.0 112.012 -178.144 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 21.7 p -63.4 -44.53 94.38 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.109 0.963 . . . . 0.0 112.974 171.781 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 599' ' ' CYS . . . . . . . . . . . . . 93.1 m -62.32 -50.96 69.56 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.042 0.937 . . . . 0.0 111.044 177.367 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 56.9 t80 -57.37 -43.75 83.84 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 123.778 0.831 . . . . 0.0 111.889 176.517 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 84.4 t60 -62.55 -40.76 97.86 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 123.64 0.776 . . . . 0.0 112.718 178.454 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 73.3 mm-40 -69.28 -36.86 77.52 Favored 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 113.46 0.911 . . . . 0.0 113.46 173.496 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 71.4 m -77.22 -45.18 27.39 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 124.077 0.951 . . . . 0.0 112.369 -176.883 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 604' ' ' SER . . . . . . . . . . . . . 8.3 t -81.02 55.92 2.63 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.603 1.561 . . . . 0.0 111.513 177.737 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 605' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.2 150.23 49.1 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 124.443 1.097 . . . . 0.0 113.094 -175.416 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 606' ' ' ASN . . . . . . . . . . . . . 58.7 t30 54.32 -91.92 0.03 OUTLIER 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 126.78 2.032 . . . . 0.0 113.79 -176.414 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 607' ' ' SER . . . . . . . . . . . . . 27.3 t -156.76 141.43 16.87 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 125.679 1.592 . . . . 0.0 111.136 177.834 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 608' ' ' SER . . . . . . . . . . . . . 49.7 p . . . . . 0 C--O 1.255 1.347 0 C-N-CA 125.813 1.645 . . . . 0.0 114.059 -178.477 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 533' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.621 0 N-CA-C 111.637 -0.585 . . . . 0.0 111.637 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . -72.17 137.02 24.54 Favored Glycine 0 CA--C 1.536 1.403 0 C-N-CA 124.083 0.849 . . . . 0.0 113.443 179.909 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 535' ' ' SER . . . . . . . . . . . . . 35.5 m -72.59 146.05 46.95 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 124.955 1.302 . . . . 0.0 112.994 179.611 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 536' ' ' GLU . . . . . . . . . . . . . 46.7 tt0 -82.49 84.34 7.24 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.253 1.021 . . . . 0.0 110.997 172.48 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 537' ' ' PHE . . . . . . . . . . . . . 63.9 t80 -74.55 161.32 29.85 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 124.896 1.278 . . . . 0.0 112.721 178.846 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 77.6 p -142.3 140.67 32.25 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 125.326 1.45 . . . . 0.0 112.222 177.877 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 539' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 -73.34 148.54 43.37 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.777 1.231 . . . . 0.0 113.891 -175.246 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 540' ' ' ARG . . . . . . . . . . . . . 31.1 mmm180 -89.72 -39.6 13.06 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 124.779 1.232 . . . . 0.0 112.992 175.281 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 43.4 t -165.0 153.02 11.64 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 125.358 1.463 . . . . 0.0 112.418 -173.304 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 542' ' ' ASN . . . . . . . . . . . . . 8.5 p-10 -65.3 -14.24 60.31 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 124.113 0.965 . . . . 0.0 113.003 169.209 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 -68.11 -19.67 64.86 Favored 'General case' 0 CA--C 1.543 0.685 0 O-C-N 120.717 -1.24 . . . . 0.0 113.358 172.748 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 81.9 mt -72.43 -38.04 68.45 Favored 'General case' 0 N--CA 1.471 0.598 0 O-C-N 121.356 -0.84 . . . . 0.0 111.654 170.05 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 47.6 tp10 -68.52 -15.18 63.45 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 125.401 1.48 . . . . 0.0 113.31 -177.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 23.3 mm -56.56 -41.6 73.73 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 C-N-CA 125.165 1.386 . . . . 0.0 111.173 173.568 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 21.2 mmt85 -65.54 -36.65 84.42 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 124.526 1.131 . . . . 0.0 112.321 176.682 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -68.4 -14.27 66.47 Favored Glycine 0 CA--C 1.528 0.901 0 C-N-CA 126.215 1.864 . . . . 0.0 114.278 -179.886 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 65.7 mmtt -76.6 95.26 3.9 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 118.731 1.265 . . . . 0.0 108.659 168.799 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 30.9 p90 -105.91 162.0 13.96 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 113.736 -1.575 . . . . 0.0 111.814 170.353 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 4.3 m -127.85 142.25 44.21 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.617 0 C-N-CA 125.912 1.685 . . . . 0.0 109.803 172.042 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 94.5 t -69.19 135.32 28.59 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 O-C-N 121.606 -0.684 . . . . 0.0 110.742 -176.656 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 97.5 t -68.98 119.73 71.67 Favored Pre-proline 0 CA--C 1.545 0.752 0 C-N-CA 124.04 0.936 . . . . 0.0 108.985 173.283 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo -76.21 154.67 37.07 Favored 'Trans proline' 0 CA--C 1.535 0.568 0 C-N-CA 123.189 2.593 . . . . 0.0 112.472 -177.556 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 17.3 pt-20 -65.3 -17.29 64.39 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 113.199 0.814 . . . . 0.0 113.199 173.779 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 77.4 p -73.09 -22.39 60.58 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.113 0.965 . . . . 0.0 113.005 173.807 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 30.5 t -79.2 110.38 14.41 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 119.281 0.946 . . . . 0.0 110.889 173.578 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 26.5 mp0 -71.95 -31.11 66.0 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.208 1.003 . . . . 0.0 112.53 -178.635 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 66.6 m-20 -108.71 -2.8 18.36 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 125.508 1.523 . . . . 0.0 113.998 -174.793 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 7.4 mtt 55.22 37.53 29.04 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.524 1.53 . . . . 0.0 112.889 -171.718 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -133.02 142.19 48.68 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.312 1.045 . . . . 0.0 113.292 -173.338 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 28.0 t80 -152.63 159.76 43.2 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 125.799 1.64 . . . . 0.0 109.789 174.09 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 38.8 ttmt -118.16 134.71 54.75 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 124.583 1.153 . . . . 0.0 113.737 -170.429 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 19.6 t -73.03 116.78 53.96 Favored Pre-proline 0 CA--C 1.541 0.617 0 C-N-CA 126.104 1.762 . . . . 0.0 110.509 169.308 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 93.2 Cg_endo -71.77 -18.04 28.8 Favored 'Trans proline' 0 CA--C 1.543 0.951 0 C-N-CA 122.892 2.394 . . . . 0.0 113.974 173.315 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 73.6 mt -72.04 -56.67 9.37 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 C-N-CA 123.948 0.899 . . . . 0.0 110.413 -177.456 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 15.6 p -100.99 -0.67 36.11 Favored 'General case' 0 CA--C 1.552 1.055 0 N-CA-C 113.911 1.078 . . . . 0.0 113.911 178.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 568' ' ' LYS . . . . . . . . . . . . . 33.6 tttt 63.73 39.61 8.42 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 126.644 1.978 . . . . 0.0 113.824 -179.041 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 78.6 mm-40 -123.59 138.49 54.54 Favored 'General case' 0 N--CA 1.481 1.099 0 N-CA-C 114.136 1.161 . . . . 0.0 114.136 -171.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 80.5 m -83.64 122.48 28.66 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 124.589 1.155 . . . . 0.0 112.42 -179.28 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 1.7 t -79.33 141.49 15.29 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 C-N-CA 124.715 1.206 . . . . 0.0 109.223 168.106 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 43.1 p -113.66 138.72 49.81 Favored 'General case' 0 N--CA 1.475 0.825 0 C-N-CA 124.67 1.188 . . . . 0.0 109.997 169.28 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -65.97 150.8 51.94 Favored Glycine 0 CA--C 1.535 1.287 0 C-N-CA 124.756 1.169 . . . . 0.0 113.756 -178.44 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 84.3 t -138.05 133.7 44.31 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.858 0 C-N-CA 125.747 1.619 . . . . 0.0 111.598 -176.291 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 70.2 t80 -69.27 141.75 54.29 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-N 119.742 1.156 . . . . 0.0 113.039 179.067 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -126.6 130.64 50.9 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.543 1.137 . . . . 0.0 111.445 172.788 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 80.9 mt-10 -71.72 -25.79 62.22 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 113.541 0.941 . . . . 0.0 113.541 176.848 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -74.23 -42.13 60.23 Favored 'General case' 0 N--CA 1.479 1.023 0 CA-C-N 118.98 0.809 . . . . 0.0 111.481 177.859 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 33.1 m -75.11 -31.57 61.17 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 124.302 1.041 . . . . 0.0 112.029 171.037 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 71.39 22.25 78.59 Favored Glycine 0 CA--C 1.534 1.226 0 C-N-CA 123.959 0.79 . . . . 0.0 112.265 -169.74 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -153.82 166.95 31.29 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 126.382 1.873 . . . . 0.0 112.13 -169.406 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 70.2 m95 -76.69 142.99 40.34 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.728 1.211 . . . . 0.0 111.893 175.718 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 28.9 m -139.74 148.09 23.4 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 C-N-CA 126.663 1.985 . . . . 0.0 112.086 -172.906 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 4.7 m0 -97.71 98.98 10.33 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 127.386 2.275 . . . . 0.0 107.598 170.851 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 66.3 mttm -75.22 154.4 37.57 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 124.412 1.085 . . . . 0.0 111.525 179.808 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 62.1 t30 49.59 40.23 19.0 Favored 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 125.087 1.355 . . . . 0.0 112.411 -174.509 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 96.8 m -130.12 137.94 50.41 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 124.835 1.254 . . . . 0.0 111.383 -175.921 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 11.1 tt -133.75 140.13 47.2 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 C-N-CA 126.363 1.865 . . . . 0.0 112.121 -168.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 69.2 tt0 -97.51 132.34 43.29 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.502 1.121 . . . . 0.0 110.621 169.863 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 7.7 p -145.79 127.57 8.35 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.616 0 C-N-CA 125.352 1.461 . . . . 0.0 111.02 171.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 61.9 m-20 53.3 36.81 23.75 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 124.993 1.317 . . . . 0.0 113.828 175.372 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 79.67 8.5 87.67 Favored Glycine 0 CA--C 1.539 1.575 0 C-N-CA 124.67 1.129 . . . . 0.0 115.383 -179.368 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 58.9 mtmt -123.5 160.69 26.41 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 126.29 1.836 . . . . 0.0 111.114 178.247 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 75.3 m-85 -113.27 143.19 44.84 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 124.177 0.991 . . . . 0.0 113.635 179.832 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 21.5 m-30 -139.93 171.82 13.66 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 128.247 2.619 . . . . 0.0 109.77 179.709 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 596' ' ' HIS . . . . . . . . . . . . . 20.0 m80 -83.79 143.05 30.22 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 107.976 -1.12 . . . . 0.0 107.976 166.409 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 11.3 m -65.26 -41.35 94.35 Favored 'General case' 0 N--CA 1.473 0.68 0 O-C-N 122.089 -0.382 . . . . 0.0 111.897 -176.72 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 21.3 p -65.55 -42.01 92.36 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-O 118.561 -0.733 . . . . 0.0 112.843 171.84 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 599' ' ' CYS . . . . . . . . . . . . . 67.4 m -59.83 -54.02 51.17 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 119.301 0.955 . . . . 0.0 111.605 178.883 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -54.73 -51.83 64.4 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 123.246 0.618 . . . . 0.0 109.929 175.093 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 85.8 t60 -56.71 -45.86 81.61 Favored 'General case' 0 N--CA 1.47 0.542 0 N-CA-C 114.222 1.193 . . . . 0.0 114.222 -179.607 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -80.49 -26.91 37.92 Favored 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 113.946 1.091 . . . . 0.0 113.946 -179.176 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 93.0 m -84.3 -33.73 23.89 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.936 0.895 . . . . 0.0 112.109 -177.854 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 604' ' ' SER . . . . . . . . . . . . . 11.1 t -144.8 71.17 1.29 Allowed 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 124.819 1.248 . . . . 0.0 110.811 -176.522 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 605' ' ' GLN . . . . . . . . . . . . . 52.7 tt0 -70.91 -31.22 67.78 Favored 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 123.88 0.872 . . . . 0.0 112.354 177.118 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 606' ' ' ASN . . . . . . . . . . . . . 62.2 t30 -70.65 154.01 42.28 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 125.258 1.423 . . . . 0.0 112.071 173.799 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 607' ' ' SER . . . . . . . . . . . . . 49.2 m -126.39 148.17 49.65 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 124.978 1.311 . . . . 0.0 112.853 -177.09 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 608' ' ' SER . . . . . . . . . . . . . 6.7 t . . . . . 0 C--O 1.254 1.328 0 C-N-CA 127.824 2.45 . . . . 0.0 114.068 -177.616 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 533' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.629 0 N-CA-C 112.078 -0.409 . . . . 0.0 112.078 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . -72.25 164.48 54.45 Favored Glycine 0 CA--C 1.538 1.516 0 C-N-CA 124.332 0.967 . . . . 0.0 114.158 177.317 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 535' ' ' SER . . . . . . . . . . . . . 80.8 p -153.49 153.77 33.08 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 125.225 1.41 . . . . 0.0 112.316 -179.128 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 536' ' ' GLU . . . . . . . . . . . . . 24.5 mp0 -77.85 151.71 33.76 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.392 1.077 . . . . 0.0 112.084 175.288 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 537' ' ' PHE . . . . . . . . . . . . . 3.3 t80 -82.86 10.43 7.79 Favored 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 125.18 1.392 . . . . 0.0 113.59 -179.917 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 18.9 m -62.46 130.78 46.74 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 125.386 1.474 . . . . 0.0 113.071 -173.368 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 539' ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -74.38 149.45 40.52 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.202 1.401 . . . . 0.0 113.95 -173.526 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 540' ' ' ARG . . . . . . . . . . . . . 10.6 mpt_? -116.11 167.97 10.52 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 126.644 1.978 . . . . 0.0 111.731 177.362 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 23.4 t -61.1 -31.49 71.18 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 124.839 1.255 . . . . 0.0 114.14 -177.297 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 542' ' ' ASN . . . . . . . . . . . . . 5.4 p-10 -144.42 151.6 39.46 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.847 1.659 . . . . 0.0 110.941 174.427 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 31.2 tp10 -91.56 -65.42 1.01 Allowed 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 123.791 0.836 . . . . 0.0 112.874 -174.867 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -155.65 -8.5 0.12 Allowed 'General case' 0 N--CA 1.48 1.073 0 N-CA-C 116.861 2.171 . . . . 0.0 116.861 -174.618 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -60.23 -22.02 62.52 Favored 'General case' 0 N--CA 1.478 0.936 0 N-CA-C 116.001 1.852 . . . . 0.0 116.001 -168.061 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 22.3 mm -52.66 -42.06 39.77 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 C-N-CA 124.968 1.307 . . . . 0.0 113.032 -173.111 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 23.4 ptt180 -72.11 -17.79 61.95 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 113.661 0.986 . . . . 0.0 113.661 -176.625 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -75.62 -11.39 84.47 Favored Glycine 0 CA--C 1.535 1.33 0 C-N-CA 124.856 1.217 . . . . 0.0 114.165 -178.071 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -70.56 131.69 44.37 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 118.565 1.182 . . . . 0.0 110.732 174.766 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 50.0 p90 -140.58 163.94 31.51 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 124.79 1.236 . . . . 0.0 111.967 174.624 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 21.3 m -127.92 143.29 41.28 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 C-N-CA 126.004 1.721 . . . . 0.0 109.733 172.689 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 92.3 t -69.67 134.61 29.84 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.149 0 O-C-N 120.662 -1.274 . . . . 0.0 109.747 175.644 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 85.7 t -63.27 122.96 78.83 Favored Pre-proline 0 CA--C 1.544 0.746 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 179.137 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -72.85 151.07 50.61 Favored 'Trans proline' 0 CA--C 1.538 0.681 0 C-N-CA 122.572 2.182 . . . . 0.0 112.684 -175.595 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 16.0 pt-20 -62.61 -21.01 65.32 Favored 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 113.87 1.063 . . . . 0.0 113.87 179.359 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 45.8 p -74.68 -30.18 61.48 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 125.629 1.572 . . . . 0.0 113.208 176.014 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 62.3 m -87.19 79.76 8.49 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 123.617 0.767 . . . . 0.0 112.006 -177.911 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 85.9 mt-30 -58.4 -32.97 69.13 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 125.138 1.375 . . . . 0.0 113.501 -177.702 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 16.6 t0 -77.65 -12.47 59.97 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 124.764 1.226 . . . . 0.0 113.297 176.604 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 6.5 mtt 52.75 35.99 20.02 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 126.135 1.774 . . . . 0.0 113.364 -175.978 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -142.05 149.73 40.33 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.364 1.065 . . . . 0.0 112.47 -178.221 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 9.3 t80 -153.32 155.24 36.12 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 124.01 0.924 . . . . 0.0 110.825 177.329 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 28.3 ttpp -99.85 134.31 42.95 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 123.969 0.908 . . . . 0.0 113.27 -175.47 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 40.7 t -76.27 116.13 53.34 Favored Pre-proline 0 CA--C 1.541 0.614 0 C-N-CA 127.006 2.122 . . . . 0.0 110.622 169.286 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -62.66 -28.31 76.67 Favored 'Trans proline' 0 CA--C 1.542 0.901 0 C-N-CA 122.708 2.272 . . . . 0.0 114.597 175.686 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 87.3 mt -70.6 -60.47 2.41 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.2 0 CA-C-N 118.845 0.748 . . . . 0.0 111.427 -174.54 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 15.6 p -93.72 -1.99 54.39 Favored 'General case' 0 CA--C 1.549 0.929 0 N-CA-C 113.596 0.961 . . . . 0.0 113.596 179.837 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 568' ' ' LYS . . . . . . . . . . . . . 2.2 mptp? 60.48 43.47 13.06 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 126.959 2.104 . . . . 0.0 112.205 -177.417 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 75.0 mm-40 -123.31 140.73 52.71 Favored 'General case' 0 N--CA 1.482 1.134 0 N-CA-C 114.401 1.26 . . . . 0.0 114.401 -173.645 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 97.5 m -82.06 116.74 21.79 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 123.863 0.865 . . . . 0.0 111.817 179.078 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 2.9 p -79.56 149.47 5.36 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.885 0 C-N-CA 124.411 1.084 . . . . 0.0 110.076 167.949 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 44.5 p -126.07 142.8 51.37 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 124.816 1.246 . . . . 0.0 111.319 -179.376 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -72.81 147.11 39.48 Favored Glycine 0 CA--C 1.529 0.932 0 C-N-CA 124.758 1.171 . . . . 0.0 112.893 -178.291 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 62.5 t -135.09 130.23 51.47 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.421 0 C-N-CA 124.583 1.153 . . . . 0.0 111.749 -178.979 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 68.5 t80 -68.39 115.78 8.21 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 122.993 0.517 . . . . 0.0 112.078 178.354 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 37.2 t0 -86.44 119.4 26.66 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 123.89 0.876 . . . . 0.0 110.006 169.386 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 63.7 mt-10 -69.25 -23.1 63.81 Favored 'General case' 0 CA--C 1.548 0.869 0 N-CA-C 113.2 0.815 . . . . 0.0 113.2 177.18 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 8.4 tm-20 -79.78 -47.76 14.69 Favored 'General case' 0 CA--C 1.541 0.61 0 O-C-N 121.211 -0.931 . . . . 0.0 111.724 -179.38 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 47.7 m -71.94 -28.42 63.45 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.775 0.83 . . . . 0.0 112.379 169.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 75.21 24.27 71.71 Favored Glycine 0 CA--C 1.533 1.212 0 C-N-CA 124.686 1.136 . . . . 0.0 113.933 -173.538 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -148.13 159.86 43.49 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 125.983 1.713 . . . . 0.0 111.812 -170.791 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 73.7 m95 -76.87 139.69 40.34 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 123.922 0.889 . . . . 0.0 111.731 -179.894 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 16.8 m -132.87 150.43 32.95 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 126.039 1.736 . . . . 0.0 112.591 -179.181 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 7.8 m0 -100.15 101.43 12.47 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 127.409 2.283 . . . . 0.0 107.829 173.079 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 73.8 mmtt -70.71 151.75 44.57 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 124.986 1.314 . . . . 0.0 111.56 -178.688 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 59.4 t30 49.57 40.4 19.3 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 125.442 1.497 . . . . 0.0 112.962 -177.862 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 99.9 m -123.86 147.74 47.37 Favored 'General case' 0 N--CA 1.485 1.309 0 O-C-N 121.005 -1.06 . . . . 0.0 112.476 -171.232 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 16.4 tt -142.55 148.73 19.67 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.631 0 C-N-CA 127.75 2.42 . . . . 0.0 110.049 -178.169 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 69.5 tt0 -108.34 130.47 55.2 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.421 1.088 . . . . 0.0 110.784 170.294 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 9.4 p -153.31 145.47 14.79 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.911 0 C-N-CA 125.06 1.344 . . . . 0.0 110.503 177.069 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 8.1 t-20 53.59 30.94 11.62 Favored 'General case' 0 CA--C 1.552 1.028 0 C-N-CA 124.944 1.297 . . . . 0.0 113.571 -177.655 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 76.6 11.22 85.43 Favored Glycine 0 CA--C 1.539 1.585 0 C-N-CA 124.976 1.274 . . . . 0.0 115.916 -179.323 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -135.25 161.03 36.55 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 125.914 1.686 . . . . 0.0 112.365 -179.75 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 69.6 m-85 -90.05 150.24 22.18 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 113.684 0.994 . . . . 0.0 113.684 178.258 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 89.1 m-85 -149.94 163.28 38.51 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 127.382 2.273 . . . . 0.0 109.955 -176.63 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 596' ' ' HIS . . . . . . . . . . . . . 29.4 m80 -81.07 140.61 35.0 Favored 'General case' 0 N--CA 1.471 0.602 0 O-C-N 121.343 -0.848 . . . . 0.0 109.224 168.716 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 23.6 t -62.62 -45.43 92.88 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 123.353 0.661 . . . . 0.0 112.02 -178.695 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 24.5 p -63.36 -44.34 95.1 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 123.871 0.868 . . . . 0.0 112.777 173.929 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 599' ' ' CYS . . . . . . . . . . . . . 97.2 m -57.77 -53.57 56.72 Favored 'General case' 0 CA--C 1.544 0.72 0 CA-C-N 119.134 0.879 . . . . 0.0 111.404 176.897 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 80.9 t80 -57.82 -45.79 85.63 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.335 1.054 . . . . 0.0 112.308 177.367 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 48.1 t-80 -62.9 -43.05 99.84 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 124.005 0.922 . . . . 0.0 113.011 177.628 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 62.9 mt-10 -73.0 -30.38 63.74 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 123.867 0.867 . . . . 0.0 113.117 178.342 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 51.5 m -73.21 -35.68 66.38 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 124.267 1.027 . . . . 0.0 112.13 175.01 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 604' ' ' SER . . . . . . . . . . . . . 33.3 t -63.91 134.04 54.4 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.273 1.029 . . . . 0.0 112.072 174.202 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 605' ' ' GLN . . . . . . . . . . . . . 76.1 mt-30 -143.25 161.02 39.39 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 125.691 1.596 . . . . 0.0 111.488 -175.911 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 606' ' ' ASN . . . . . . . . . . . . . 62.3 t30 55.99 33.37 21.66 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 125.561 1.544 . . . . 0.0 113.954 179.854 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 607' ' ' SER . . . . . . . . . . . . . 24.2 t -67.06 -27.25 67.23 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 124.72 1.208 . . . . 0.0 113.646 -175.796 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 608' ' ' SER . . . . . . . . . . . . . 39.8 m . . . . . 0 C--O 1.254 1.309 0 C-N-CA 127.14 2.176 . . . . 0.0 113.475 179.736 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 533' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.498 0 N-CA-C 111.206 -0.758 . . . . 0.0 111.206 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . -176.13 165.85 36.61 Favored Glycine 0 CA--C 1.537 1.408 0 C-N-CA 124.571 1.081 . . . . 0.0 113.38 178.246 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 535' ' ' SER . . . . . . . . . . . . . 82.6 p -76.42 164.22 26.2 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.976 1.31 . . . . 0.0 112.931 176.384 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 536' ' ' GLU . . . . . . . . . . . . . 60.9 mt-10 -74.25 93.51 2.36 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 124.086 0.955 . . . . 0.0 111.213 173.446 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 537' ' ' PHE . . . . . . . . . . . . . 23.8 t80 -147.3 134.78 20.84 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.454 1.502 . . . . 0.0 109.944 175.943 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 28.9 t -80.83 -81.51 0.13 Allowed 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 115.237 1.569 . . . . 0.0 115.237 -168.054 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 539' ' ' ASP . . . . . . . . . . . . . 12.7 p-10 -80.73 153.53 27.77 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 124.586 1.155 . . . . 0.0 112.953 -170.81 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 540' ' ' ARG . . . . . . . . . . . . . 6.5 mpt_? 51.12 42.31 28.55 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 124.943 1.297 . . . . 0.0 112.337 -176.385 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 47.3 t -146.81 163.93 34.44 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 126.839 2.055 . . . . 0.0 111.207 -174.927 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 542' ' ' ASN . . . . . . . . . . . . . 81.3 m-20 -60.0 -25.61 65.4 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.003 0.921 . . . . 0.0 113.367 178.526 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 29.6 tp10 -58.65 -35.07 71.94 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 124.199 0.999 . . . . 0.0 113.065 173.441 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 10.5 tt -76.11 -43.69 42.11 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 124.024 0.93 . . . . 0.0 110.942 172.659 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -70.36 -46.6 63.79 Favored 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 114.144 1.164 . . . . 0.0 114.144 -171.433 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 24.0 mm -60.67 -32.12 50.93 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.003 0 CA-C-N 118.925 0.784 . . . . 0.0 111.324 -174.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 88.8 mtt-85 -70.1 -30.38 67.59 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 124.105 0.962 . . . . 0.0 112.959 176.905 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -79.73 -9.47 86.77 Favored Glycine 0 CA--C 1.536 1.369 0 C-N-CA 125.637 1.589 . . . . 0.0 114.535 178.572 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 58.9 mtpt -75.64 132.62 40.73 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.719 1.207 . . . . 0.0 111.154 177.063 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 23.5 p90 -153.3 166.55 32.24 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 125.234 1.414 . . . . 0.0 111.387 176.141 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -130.89 133.72 62.69 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 C-N-CA 124.915 1.286 . . . . 0.0 110.483 175.671 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 73.4 t -64.15 134.34 29.04 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 C-N-CA 124.168 0.987 . . . . 0.0 110.405 -178.152 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 59.0 t -70.97 116.5 47.07 Favored Pre-proline 0 CA--C 1.544 0.739 0 CA-C-O 118.627 -0.702 . . . . 0.0 109.467 173.741 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -83.37 154.8 14.21 Favored 'Trans proline' 0 N--CA 1.457 -0.642 0 C-N-CA 123.546 2.831 . . . . 0.0 111.607 179.949 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 3.9 pm0 -64.37 -22.39 66.94 Favored 'General case' 0 N--CA 1.471 0.577 0 O-C-N 121.089 -1.007 . . . . 0.0 112.675 174.435 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 67.6 p -71.85 -17.65 62.12 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 125.131 1.372 . . . . 0.0 113.064 175.936 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 61.0 p -74.05 -35.53 64.29 Favored 'General case' 0 N--CA 1.48 1.066 0 CA-C-N 119.278 0.945 . . . . 0.0 112.177 175.811 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 57.3 tt0 59.76 -49.17 0.08 Allowed 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 129.94 3.296 . . . . 0.0 115.994 -177.366 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 71.8 m-20 -80.23 -11.15 59.76 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.6 1.56 . . . . 0.0 113.883 177.719 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 63.5 mtp 57.59 27.19 13.8 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 125.889 1.675 . . . . 0.0 114.517 -179.3 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -145.83 147.65 32.05 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.327 1.051 . . . . 0.0 113.483 -175.421 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 40.2 m-85 -149.79 164.97 33.87 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 127.051 2.14 . . . . 0.0 110.276 175.304 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 38.1 ttmt -114.09 132.04 56.18 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 124.496 1.119 . . . . 0.0 112.815 -177.881 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 13.1 t -66.94 112.67 10.34 Favored Pre-proline 0 CA--C 1.542 0.655 0 C-N-CA 126.284 1.834 . . . . 0.0 109.744 168.437 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -70.16 -18.87 34.84 Favored 'Trans proline' 0 CA--C 1.54 0.796 0 C-N-CA 122.5 2.134 . . . . 0.0 113.024 176.494 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 36.5 mt -70.93 -50.11 45.32 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 C-N-CA 124.839 1.256 . . . . 0.0 110.968 -175.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 15.6 p -108.55 -2.09 19.15 Favored 'General case' 0 CA--C 1.552 1.028 0 C-N-CA 124.906 1.283 . . . . 0.0 113.607 178.425 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 568' ' ' LYS . . . . . . . . . . . . . 96.0 mttt 60.44 46.59 9.63 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 126.913 2.085 . . . . 0.0 112.697 -177.507 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 72.1 mm-40 -126.04 141.88 51.76 Favored 'General case' 0 N--CA 1.481 1.078 0 N-CA-C 114.688 1.366 . . . . 0.0 114.688 -176.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 93.7 m -86.23 130.56 34.48 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 123.781 0.832 . . . . 0.0 112.979 -176.535 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 3.0 m -94.78 151.43 3.82 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.891 0 C-N-CA 125.779 1.631 . . . . 0.0 111.088 167.514 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 65.8 p -134.15 149.52 51.05 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 125.414 1.486 . . . . 0.0 111.27 178.158 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -67.69 143.8 42.67 Favored Glycine 0 CA--C 1.536 1.363 0 C-N-CA 124.219 0.914 . . . . 0.0 114.868 -177.42 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 98.8 t -139.67 136.0 39.51 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 125.596 1.558 . . . . 0.0 112.091 -179.703 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 75.2 t80 -73.25 123.58 23.99 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 120.241 1.382 . . . . 0.0 112.97 -177.262 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 16.1 t0 -91.62 123.01 34.7 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 125.641 1.576 . . . . 0.0 111.274 169.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -72.37 -24.59 61.29 Favored 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 114.131 1.16 . . . . 0.0 114.131 177.125 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -73.84 -53.74 9.55 Favored 'General case' 0 N--CA 1.476 0.826 0 CA-C-N 119.09 0.859 . . . . 0.0 111.661 -176.299 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 15.4 t -78.6 -27.46 45.55 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 123.831 0.853 . . . . 0.0 112.201 172.749 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 79.45 32.54 37.83 Favored Glycine 0 CA--C 1.532 1.144 0 C-N-CA 124.032 0.825 . . . . 0.0 113.2 -175.754 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 77.6 mm-40 -141.49 155.92 45.79 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.73 1.612 . . . . 0.0 111.777 -170.421 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 79.7 m95 -76.08 138.32 40.74 Favored 'General case' 0 CA--C 1.534 0.358 0 O-C-N 120.967 -1.083 . . . . 0.0 111.468 173.584 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 18.7 m -138.8 151.03 23.62 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.019 0 C-N-CA 126.657 1.983 . . . . 0.0 113.002 -173.273 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 4.3 m0 -94.93 104.19 16.07 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 126.376 1.87 . . . . 0.0 108.639 168.632 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 53.9 mtmt -69.5 145.87 52.34 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 124.305 1.042 . . . . 0.0 111.443 -177.487 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 48.0 t30 48.96 44.76 22.65 Favored 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 125.326 1.45 . . . . 0.0 112.194 -178.236 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 87.9 m -131.77 146.35 52.1 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 124.528 1.131 . . . . 0.0 111.993 -173.058 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 13.0 tt -139.66 151.79 22.53 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.724 0 C-N-CA 127.967 2.507 . . . . 0.0 109.979 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 81.0 tt0 -107.93 117.77 35.01 Favored 'General case' 0 N--CA 1.472 0.67 0 O-C-N 120.889 -1.132 . . . . 0.0 110.734 172.099 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 5.0 t -144.18 138.38 24.13 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 C-N-CA 125.511 1.524 . . . . 0.0 110.506 -175.567 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 14.5 m120 54.39 34.49 20.9 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 124.973 1.309 . . . . 0.0 113.678 -179.57 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 75.77 11.27 84.68 Favored Glycine 0 CA--C 1.536 1.4 0 C-N-CA 124.773 1.178 . . . . 0.0 115.58 -179.329 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 64.1 mttp -132.21 157.08 45.24 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 125.96 1.704 . . . . 0.0 111.614 -179.298 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 74.8 m-85 -88.38 130.97 35.02 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 121.685 0.755 . . . . 0.0 111.566 174.241 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 12.1 m-30 -124.72 156.68 37.25 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 127.104 2.162 . . . . 0.0 109.696 -176.523 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 596' ' ' HIS . . . . . . . . . . . . . 29.6 m80 -79.87 140.98 36.55 Favored 'General case' 0 N--CA 1.47 0.573 0 O-C-N 120.837 -1.164 . . . . 0.0 108.184 167.085 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 19.1 m -66.8 -38.31 86.26 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 118.841 0.746 . . . . 0.0 112.262 -179.251 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 23.4 p -65.65 -37.86 87.72 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 123.872 0.869 . . . . 0.0 113.187 172.042 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 599' ' ' CYS . . . . . . . . . . . . . 68.0 m -61.71 -58.63 7.28 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 123.881 0.872 . . . . 0.0 110.089 172.7 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 58.1 t80 -53.48 -39.64 64.69 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 125.329 1.452 . . . . 0.0 113.517 -179.782 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 82.1 t60 -60.79 -27.16 67.81 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 113.85 1.056 . . . . 0.0 113.85 177.619 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 57.7 mm-40 -109.36 -7.95 15.14 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 125.571 1.549 . . . . 0.0 114.258 -179.958 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 19.3 m -66.94 -36.78 83.0 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 124.572 1.149 . . . . 0.0 113.082 -173.857 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 604' ' ' SER . . . . . . . . . . . . . 12.5 t -152.31 166.5 31.62 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 124.092 0.957 . . . . 0.0 112.325 179.678 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 605' ' ' GLN . . . . . . . . . . . . . 29.5 pt20 -60.54 149.4 34.71 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.79 1.236 . . . . 0.0 112.471 174.456 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 606' ' ' ASN . . . . . . . . . . . . . 28.1 m120 -79.78 -88.95 0.06 Allowed 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 123.848 0.859 . . . . 0.0 112.379 -174.529 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 607' ' ' SER . . . . . . . . . . . . . 37.0 m 53.89 -164.2 0.1 Allowed 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 125.328 1.451 . . . . 0.0 113.626 -175.539 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 608' ' ' SER . . . . . . . . . . . . . 80.8 p . . . . . 0 C--O 1.253 1.288 0 C-N-CA 126.562 1.945 . . . . 0.0 113.059 178.111 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 533' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.486 0 N-CA-C 111.117 -0.793 . . . . 0.0 111.117 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . -69.86 166.72 49.26 Favored Glycine 0 CA--C 1.537 1.426 0 C-N-CA 124.091 0.853 . . . . 0.0 113.909 175.768 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 535' ' ' SER . . . . . . . . . . . . . 21.9 m -63.46 137.84 58.29 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.55 1.14 . . . . 0.0 112.871 -178.229 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 536' ' ' GLU . . . . . . . . . . . . . 24.0 tp10 -152.46 128.24 10.2 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 125.819 1.648 . . . . 0.0 109.21 175.689 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 537' ' ' PHE . . . . . . . . . . . . . 70.0 t80 -72.65 127.52 32.8 Favored 'General case' 0 CA--C 1.54 0.594 0 N-CA-C 113.053 0.76 . . . . 0.0 113.053 -171.581 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 22.7 t -160.75 50.26 0.26 Allowed 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 126.504 1.921 . . . . 0.0 108.766 171.907 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 539' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -129.06 179.09 5.95 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 125.484 1.513 . . . . 0.0 113.882 -167.257 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 540' ' ' ARG . . . . . . . . . . . . . 62.5 mtp85 63.96 4.0 1.85 Allowed 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 127.531 2.332 . . . . 0.0 116.642 175.41 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 45.7 m -65.99 160.01 24.57 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.977 1.311 . . . . 0.0 112.02 169.439 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 542' ' ' ASN . . . . . . . . . . . . . 16.2 p-10 -59.58 -23.94 63.35 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 113.673 0.99 . . . . 0.0 113.673 176.795 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 52.7 mt-10 -55.46 -30.94 61.48 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.608 1.163 . . . . 0.0 112.824 175.348 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 10.0 mp -59.66 -36.17 75.88 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 119.321 0.964 . . . . 0.0 111.793 175.773 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 82.2 mm-40 -84.66 -43.8 14.03 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 123.619 0.768 . . . . 0.0 112.818 178.511 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 34.9 mm -69.1 -28.29 38.57 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.835 0 O-C-N 121.914 -0.491 . . . . 0.0 111.824 -178.25 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . 0.269 0.0 OUTLIER -76.27 -13.94 60.14 Favored 'General case' 0 N--CA 1.486 1.347 0 O-C-N 120.505 -1.372 . . . . 0.0 113.54 175.856 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -70.6 -12.95 70.91 Favored Glycine 0 CA--C 1.537 1.414 0 C-N-CA 124.751 1.167 . . . . 0.0 113.9 170.914 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 32.0 mmtp -75.03 127.6 33.61 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 118.767 1.283 . . . . 0.0 110.364 171.245 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 39.9 p90 -149.62 164.24 35.68 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 123.854 0.861 . . . . 0.0 112.713 173.737 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -134.24 133.15 55.63 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 C-N-CA 126.15 1.78 . . . . 0.0 109.644 174.634 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 53.8 t -67.23 135.28 28.83 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.94 0 C-N-CA 123.774 0.83 . . . . 0.0 110.834 -176.72 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 19.0 t -74.28 116.21 50.58 Favored Pre-proline 0 N--CA 1.474 0.729 0 N-CA-C 108.518 -0.919 . . . . 0.0 108.518 171.523 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_endo -77.05 151.13 30.33 Favored 'Trans proline' 0 N--CA 1.458 -0.586 0 C-N-CA 122.752 2.301 . . . . 0.0 111.302 175.456 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -62.65 -22.36 66.38 Favored 'General case' 0 N--CA 1.477 0.876 0 O-C-N 121.376 -0.827 . . . . 0.0 112.942 175.069 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 20.6 m -64.32 -28.32 69.63 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 125.353 1.461 . . . . 0.0 113.487 171.685 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 42.3 t -78.14 125.97 30.13 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 123.934 0.894 . . . . 0.0 112.181 179.639 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 1.7 pm0 -81.31 152.66 27.45 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.363 1.065 . . . . 0.0 111.868 170.197 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 36.3 m-20 60.75 -11.93 0.05 OUTLIER 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 127.642 2.377 . . . . 0.0 117.365 176.848 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 46.9 mtp 57.34 32.76 22.29 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 126.098 1.759 . . . . 0.0 114.194 173.448 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -151.33 155.54 38.92 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.827 1.251 . . . . 0.0 112.797 -171.674 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -152.97 154.44 34.99 Favored 'General case' 0 CA--C 1.542 0.673 0 N-CA-C 113.09 0.774 . . . . 0.0 113.09 173.237 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 14.5 tptm -77.88 142.0 38.74 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 125.107 1.363 . . . . 0.0 113.226 -178.116 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 14.8 t -94.45 107.25 28.47 Favored Pre-proline 0 CA--C 1.539 0.554 0 C-N-CA 125.165 1.386 . . . . 0.0 108.979 167.736 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 63.9 Cg_endo -67.66 -19.58 47.67 Favored 'Trans proline' 0 CA--C 1.542 0.905 0 C-N-CA 122.162 1.908 . . . . 0.0 113.529 175.851 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 89.0 mt -73.48 -56.86 8.12 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 C-N-CA 124.365 1.066 . . . . 0.0 111.178 -176.473 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 14.9 p -100.17 0.3 40.25 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 124.488 1.115 . . . . 0.0 113.794 179.242 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 568' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 59.58 44.32 14.73 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 126.818 2.047 . . . . 0.0 112.122 -179.423 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 74.7 mm-40 -115.59 -175.35 2.7 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 123.774 0.83 . . . . 0.0 112.154 179.857 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 60.6 m -125.6 128.66 48.24 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 124.403 1.081 . . . . 0.0 110.586 172.078 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 2.3 p -91.83 147.15 5.49 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 C-N-CA 124.357 1.063 . . . . 0.0 111.062 170.161 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 64.3 p -133.4 145.91 50.74 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 124.826 1.25 . . . . 0.0 111.753 -175.299 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -72.04 153.6 49.98 Favored Glycine 0 CA--C 1.537 1.413 0 C-N-CA 124.275 0.941 . . . . 0.0 113.63 -179.939 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 8.8 p -142.69 138.06 28.13 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 C-N-CA 124.362 1.065 . . . . 0.0 112.383 177.972 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 68.9 t80 -71.71 118.37 14.46 Favored 'General case' 0 CA--C 1.544 0.732 0 O-C-N 121.497 -0.752 . . . . 0.0 112.295 -178.364 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 21.8 t0 -85.22 120.9 27.23 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.32 1.048 . . . . 0.0 110.493 170.158 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 53.2 mt-10 -74.36 -22.91 59.0 Favored 'General case' 0 CA--C 1.54 0.565 0 N-CA-C 113.765 1.024 . . . . 0.0 113.765 -178.812 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 34.1 mm-40 -76.52 -51.17 12.22 Favored 'General case' 0 N--CA 1.476 0.849 0 CA-C-N 119.467 1.03 . . . . 0.0 112.998 177.203 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 15.7 t -75.07 -27.44 59.94 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 123.47 0.708 . . . . 0.0 112.071 173.736 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 75.49 32.18 55.32 Favored Glycine 0 CA--C 1.535 1.324 0 C-N-CA 124.829 1.204 . . . . 0.0 112.655 -175.002 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -143.94 150.44 38.35 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 125.506 1.522 . . . . 0.0 112.133 -170.863 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 84.7 m95 -73.71 138.97 45.0 Favored 'General case' 0 CA--C 1.537 0.474 0 O-C-N 121.288 -0.883 . . . . 0.0 111.904 175.429 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 5.5 m -134.84 141.58 42.72 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 C-N-CA 126.115 1.766 . . . . 0.0 112.9 -177.419 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 4.7 m0 -87.51 102.94 15.06 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.739 1.616 . . . . 0.0 108.854 169.338 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 73.5 mmtt -72.8 147.54 45.4 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 123.867 0.867 . . . . 0.0 111.628 -178.581 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 51.3 t30 50.45 43.76 27.0 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.959 1.304 . . . . 0.0 112.271 -177.983 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 93.0 m -126.2 147.19 49.71 Favored 'General case' 0 N--CA 1.48 1.057 0 O-C-N 120.774 -1.203 . . . . 0.0 112.899 -172.095 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 5.6 tt -139.65 144.87 27.75 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.672 0 C-N-CA 127.663 2.385 . . . . 0.0 109.668 179.964 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 87.0 tt0 -117.46 121.04 39.96 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 124.977 1.311 . . . . 0.0 110.198 173.47 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 5.2 t -142.88 131.16 19.96 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.509 0 C-N-CA 125.96 1.704 . . . . 0.0 109.746 -175.164 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 71.5 m-20 52.22 44.72 29.45 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 125.223 1.409 . . . . 0.0 112.737 174.953 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 73.33 9.85 77.93 Favored Glycine 0 CA--C 1.536 1.363 0 C-N-CA 125.157 1.36 . . . . 0.0 115.507 178.915 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 35.9 mtmm -128.58 151.86 48.97 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 126.085 1.754 . . . . 0.0 112.007 -176.415 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 69.4 m-85 -96.72 148.59 22.73 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 124.098 0.959 . . . . 0.0 112.88 174.211 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 65.3 m-85 -149.13 160.1 43.65 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.177 1.391 . . . . 0.0 110.578 177.748 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 596' ' ' HIS . . . . . . . . . . . . . 20.8 m170 -75.19 142.23 43.5 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 167.628 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 8.7 t -67.54 -42.23 83.0 Favored 'General case' 0 N--CA 1.469 0.505 0 O-C-N 121.388 -0.82 . . . . 0.0 111.867 -179.273 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 21.6 p -60.32 -38.76 84.74 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.661 0.785 . . . . 0.0 113.096 173.471 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 599' ' ' CYS . . . . . . . . . . . . . 95.1 m -68.35 -57.61 5.65 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.161 0.984 . . . . 0.0 110.727 177.385 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 54.7 t80 -65.56 -33.51 76.09 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 113.064 0.764 . . . . 0.0 113.064 -175.246 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 82.0 t60 -58.18 -36.88 73.71 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 124.742 1.217 . . . . 0.0 113.108 175.315 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 94.8 mt-10 -89.78 -26.26 20.68 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 113.648 0.981 . . . . 0.0 113.648 176.329 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 83.0 m -84.71 -37.02 21.44 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.121 0.968 . . . . 0.0 113.096 -175.037 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 604' ' ' SER . . . . . . . . . . . . . 80.6 p -63.75 149.97 45.57 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-O 121.349 0.595 . . . . 0.0 111.162 170.535 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 605' ' ' GLN . . . . . . . . . . . . . 19.3 pt20 -63.57 147.5 51.29 Favored 'General case' 0 N--CA 1.474 0.738 0 O-C-N 121.525 -0.734 . . . . 0.0 112.329 -176.478 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 606' ' ' ASN . . . . . . . . . . . . . 22.3 t-20 -62.57 131.85 50.45 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 123.748 0.819 . . . . 0.0 112.434 -174.246 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 607' ' ' SER . . . . . . . . . . . . . 80.1 p -109.54 1.59 19.84 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 126.207 1.803 . . . . 0.0 114.274 -177.053 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 608' ' ' SER . . . . . . . . . . . . . 26.1 m . . . . . 0 C--O 1.255 1.367 0 C-N-CA 126.09 1.756 . . . . 0.0 114.007 -177.794 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 533' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.601 0 N-CA-C 110.993 -0.843 . . . . 0.0 110.993 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . -164.27 24.4 0.18 Allowed Glycine 0 CA--C 1.538 1.505 0 C-N-CA 124.277 0.942 . . . . 0.0 114.513 -176.638 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 535' ' ' SER . . . . . . . . . . . . . 86.6 p -159.07 167.32 29.54 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 125.91 1.684 . . . . 0.0 111.467 -173.586 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 536' ' ' GLU . . . . . . . . . . . . 0.26 6.6 pt-20 58.17 -4.2 0.06 Allowed 'General case' 0 N--CA 1.483 1.179 0 N-CA-C 119.119 3.007 . . . . 0.0 119.119 171.32 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 537' ' ' PHE . . . . . . . . . . . . . 9.5 p90 -143.05 -176.28 4.85 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 125.043 1.337 . . . . 0.0 112.606 174.34 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 14.8 m -49.23 150.14 1.83 Allowed 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 127.15 2.18 . . . . 0.0 115.139 -174.717 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 539' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -61.2 -14.53 26.18 Favored 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 116.379 1.992 . . . . 0.0 116.379 -169.008 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 540' ' ' ARG . . . . . . . . . . . . . 3.3 mmp_? -54.37 -39.17 66.92 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 124.702 1.201 . . . . 0.0 112.702 172.865 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 23.5 m 54.42 -63.85 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 128.972 2.909 . . . . 0.0 117.907 171.331 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 542' ' ' ASN . . . . . . . . . . . . . 78.2 m-20 -72.97 -13.38 61.23 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 126.173 1.789 . . . . 0.0 114.934 -169.11 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 14.8 pt-20 -57.35 -27.49 62.3 Favored 'General case' 0 CA--C 1.547 0.849 0 CA-C-N 120.185 1.357 . . . . 0.0 114.019 -174.384 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 76.6 mt -74.34 -15.96 60.93 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 125.199 1.4 . . . . 0.0 113.631 175.679 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -107.95 -32.17 7.68 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 126.466 1.906 . . . . 0.0 112.49 178.584 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 5.9 mm -52.54 -42.32 39.4 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.928 0 C-N-CA 125.44 1.496 . . . . 0.0 111.212 173.79 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 38.4 ptt180 -64.4 -22.68 67.03 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 125.145 1.378 . . . . 0.0 114.148 176.816 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -81.25 -9.36 86.11 Favored Glycine 0 CA--C 1.533 1.164 0 C-N-CA 125.63 1.586 . . . . 0.0 114.47 -177.597 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -70.45 143.62 51.72 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 118.348 1.074 . . . . 0.0 110.684 173.336 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 38.9 p90 -151.46 165.68 33.44 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 124.09 0.956 . . . . 0.0 112.528 177.576 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -131.16 134.14 61.68 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 C-N-CA 125.612 1.565 . . . . 0.0 110.137 174.326 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 10.8 p -70.6 133.67 31.43 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 C-N-CA 123.723 0.809 . . . . 0.0 110.965 -176.164 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 5.1 t -85.24 120.26 73.18 Favored Pre-proline 0 C--O 1.238 0.493 0 C-N-CA 125.101 1.36 . . . . 0.0 110.321 173.824 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -76.5 146.25 27.29 Favored 'Trans proline' 0 C--N 1.352 0.713 0 C-N-CA 122.28 1.987 . . . . 0.0 111.146 169.583 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -62.92 -23.49 67.39 Favored 'General case' 0 N--CA 1.476 0.858 0 O-C-N 121.444 -0.785 . . . . 0.0 112.794 179.283 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 67.7 p -68.73 -18.23 64.2 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 125.49 1.516 . . . . 0.0 113.934 172.851 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 15.3 t -74.99 43.17 0.2 Allowed 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 124.881 1.272 . . . . 0.0 114.271 174.758 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 55.6 tt0 46.84 -99.13 0.04 OUTLIER 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 127.841 2.456 . . . . 0.0 114.226 170.121 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 79.7 m-20 -94.79 4.66 53.56 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 125.719 1.607 . . . . 0.0 114.712 -174.741 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 13.9 mtt 57.98 36.99 26.63 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 124.891 1.277 . . . . 0.0 114.083 -179.811 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -138.76 152.51 47.99 Favored 'General case' 0 CA--C 1.54 0.589 0 O-C-N 120.713 -1.242 . . . . 0.0 114.277 -176.584 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 17.6 t80 -151.06 174.15 13.52 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 126.139 1.776 . . . . 0.0 109.391 172.615 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 7.0 ttpm? -125.0 129.51 50.46 Favored 'General case' 0 N--CA 1.481 1.106 0 CA-C-N 120.702 1.592 . . . . 0.0 112.846 179.222 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 49.0 t -65.07 117.79 42.97 Favored Pre-proline 0 CA--C 1.538 0.482 0 C-N-CA 126.521 1.928 . . . . 0.0 111.032 172.778 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -63.96 -27.33 66.43 Favored 'Trans proline' 0 CA--C 1.54 0.791 0 C-N-CA 123.037 2.492 . . . . 0.0 115.114 176.437 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 97.0 mt -74.44 -55.18 12.83 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 124.174 0.989 . . . . 0.0 111.606 -172.492 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 15.3 p -100.74 -0.18 37.72 Favored 'General case' 0 CA--C 1.553 1.059 0 C-N-CA 124.287 1.035 . . . . 0.0 113.449 179.41 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 568' ' ' LYS . . . . . . . . . . . . . 1.6 mptp? 59.3 44.37 15.5 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 126.351 1.86 . . . . 0.0 112.041 -179.448 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 64.8 mm-40 -118.09 135.84 53.95 Favored 'General case' 0 N--CA 1.481 1.121 0 N-CA-C 114.312 1.227 . . . . 0.0 114.312 -173.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 94.0 m -76.13 116.11 16.51 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 123.427 0.691 . . . . 0.0 111.486 179.738 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 4.8 p -83.42 144.01 10.85 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.706 0 C-N-CA 124.49 1.116 . . . . 0.0 109.558 168.342 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 58.6 p -131.53 145.19 51.62 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 124.823 1.249 . . . . 0.0 110.692 178.82 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -68.7 138.01 31.21 Favored Glycine 0 CA--C 1.529 0.922 0 C-N-CA 124.327 0.965 . . . . 0.0 112.152 178.958 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 83.9 t -127.26 140.95 47.65 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.595 0 C-N-CA 124.583 1.153 . . . . 0.0 111.213 -176.586 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 65.9 t80 -64.91 124.2 21.42 Favored 'General case' 0 CA--C 1.545 0.784 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 -174.051 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 65.1 t0 -87.54 99.11 11.79 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 126.57 1.948 . . . . 0.0 109.803 172.269 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 -64.65 -24.45 67.59 Favored 'General case' 0 N--CA 1.473 0.712 0 N-CA-C 114.402 1.26 . . . . 0.0 114.402 -174.745 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 35.5 tp10 -75.34 -53.36 8.87 Favored 'General case' 0 N--CA 1.471 0.598 0 O-C-N 121.383 -0.823 . . . . 0.0 112.395 -179.187 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 65.2 m -87.74 -21.47 25.15 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 124.276 1.03 . . . . 0.0 113.189 179.5 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 79.91 30.35 43.42 Favored Glycine 0 CA--C 1.533 1.166 0 C-N-CA 124.712 1.149 . . . . 0.0 112.992 -175.382 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 79.2 mm-40 -111.33 -167.46 1.18 Allowed 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 125.861 1.664 . . . . 0.0 110.87 -177.5 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 73.3 m95 -125.41 145.89 49.86 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 125.399 1.48 . . . . 0.0 110.022 171.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 16.4 m -139.41 143.71 30.45 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.057 0 C-N-CA 124.838 1.255 . . . . 0.0 113.12 -172.135 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 12.3 m0 -94.35 102.05 14.03 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 126.036 1.735 . . . . 0.0 108.999 170.463 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 53.5 mtmt -74.14 151.13 40.13 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 125.828 1.651 . . . . 0.0 112.61 -177.275 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 54.3 t30 49.89 38.28 15.65 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 125.443 1.497 . . . . 0.0 112.825 -176.134 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 97.2 m -118.66 140.53 49.77 Favored 'General case' 0 N--CA 1.48 1.07 0 O-C-N 121.136 -0.978 . . . . 0.0 112.942 -172.212 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 14.0 tt -132.45 145.49 34.45 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.534 0 C-N-CA 127.729 2.412 . . . . 0.0 110.12 177.737 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 78.7 tt0 -108.86 131.99 54.46 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 124.861 1.264 . . . . 0.0 110.776 170.198 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 7.1 p -152.66 140.32 13.61 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 C-N-CA 124.786 1.235 . . . . 0.0 110.707 176.51 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 60.2 t30 53.4 37.68 26.1 Favored 'General case' 0 CA--C 1.553 1.084 0 C-N-CA 124.695 1.198 . . . . 0.0 113.21 179.268 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 73.35 10.2 78.49 Favored Glycine 0 CA--C 1.545 1.919 0 C-N-CA 124.828 1.204 . . . . 0.0 115.605 -179.678 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 55.4 mtmt -130.96 154.11 48.48 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 125.767 1.627 . . . . 0.0 111.979 -176.313 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 68.8 m-85 -92.91 149.56 21.17 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-O 121.949 0.88 . . . . 0.0 113.18 176.211 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -149.08 165.29 32.16 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 126.873 2.069 . . . . 0.0 109.489 -179.622 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 596' ' ' HIS . . . . . . . . . . . . . 26.1 m80 -83.52 141.49 31.59 Favored 'General case' 0 N--CA 1.467 0.388 0 O-C-N 121.68 -0.638 . . . . 0.0 109.58 168.424 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 15.3 m -64.93 -43.06 94.0 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 112.251 0.463 . . . . 0.0 112.251 -177.137 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 40.4 p -67.91 -41.75 82.19 Favored 'General case' 0 N--CA 1.481 1.104 0 N-CA-C 112.953 0.724 . . . . 0.0 112.953 175.769 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 599' ' ' CYS . . . . . . . . . . . . . 89.1 m -56.56 -54.37 46.69 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.489 1.116 . . . . 0.0 110.999 173.347 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 71.5 t80 -57.26 -45.06 84.36 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.166 0.987 . . . . 0.0 111.972 177.144 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 86.5 t60 -62.25 -42.53 99.4 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 114.071 1.137 . . . . 0.0 114.071 -179.194 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 75.1 mm-40 -80.21 -30.87 38.71 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 113.93 1.085 . . . . 0.0 113.93 177.186 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 86.6 m -93.92 -44.36 8.12 Favored 'General case' 0 N--CA 1.484 1.253 0 N-CA-C 113.357 0.873 . . . . 0.0 113.357 -171.842 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 604' ' ' SER . . . . . . . . . . . . . 19.5 m -95.02 38.33 1.13 Allowed 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.461 1.505 . . . . 0.0 113.704 -169.138 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 605' ' ' GLN . . . . . . . . . . . . . 55.4 tp60 -61.9 129.98 43.48 Favored 'General case' 0 CA--C 1.545 0.782 0 O-C-N 121.202 -0.936 . . . . 0.0 111.537 176.146 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 606' ' ' ASN . . . . . . . . . . . . . 8.7 p-10 -69.77 158.8 34.75 Favored 'General case' 0 CA--C 1.544 0.741 0 N-CA-C 114.502 1.297 . . . . 0.0 114.502 -177.654 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 607' ' ' SER . . . . . . . . . . . . . 50.8 m -78.46 161.24 27.24 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 124.535 1.134 . . . . 0.0 110.965 167.099 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 608' ' ' SER . . . . . . . . . . . . . 34.4 m . . . . . 0 C--O 1.254 1.331 0 C-N-CA 126.261 1.824 . . . . 0.0 114.151 175.856 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 533' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.46 0 N-CA-C 111.229 -0.749 . . . . 0.0 111.229 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . -79.63 -167.5 34.69 Favored Glycine 0 CA--C 1.54 1.612 0 C-N-CA 124.687 1.137 . . . . 0.0 114.547 177.329 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 535' ' ' SER . . . . . . . . . . . . . 33.6 t -148.09 142.77 26.62 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 125.876 1.67 . . . . 0.0 110.943 177.784 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 536' ' ' GLU . . . . . . . . . . . . . 56.2 mp0 -74.02 135.05 43.09 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.457 1.103 . . . . 0.0 113.106 -175.856 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 537' ' ' PHE . . . . . . . . . . . . . 52.7 p90 -156.73 175.82 13.55 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 126.301 1.84 . . . . 0.0 110.628 171.365 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 21.7 t -140.42 168.74 19.1 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.859 1.264 . . . . 0.0 112.426 -178.714 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 539' ' ' ASP . . . . . . . . . . . . . 67.3 m-20 -73.64 12.21 0.68 Allowed 'General case' 0 CA--C 1.55 0.965 0 C-N-CA 126.305 1.842 . . . . 0.0 114.867 -174.336 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 540' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 -63.08 -12.97 30.54 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 125.488 1.515 . . . . 0.0 113.745 173.924 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 81.0 p -56.69 -25.55 54.38 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 125.648 1.579 . . . . 0.0 114.546 -177.139 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 542' ' ' ASN . . . . . . . . . . . . . 29.0 m120 -62.99 -23.68 67.56 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-N 119.801 1.182 . . . . 0.0 113.485 175.346 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 85.8 mt-10 -63.48 -39.94 95.79 Favored 'General case' 0 N--CA 1.474 0.766 0 O-C-N 120.701 -1.25 . . . . 0.0 112.443 178.168 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -69.63 -27.99 65.53 Favored 'General case' 0 N--CA 1.471 0.595 0 O-C-N 121.42 -0.8 . . . . 0.0 112.047 176.92 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 57.7 mt-10 -71.4 -40.76 70.31 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 123.583 0.753 . . . . 0.0 112.186 174.57 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 31.4 mm -63.14 -37.29 79.01 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 C-N-CA 123.415 0.686 . . . . 0.0 111.022 172.17 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -69.93 -28.5 65.63 Favored 'General case' 0 N--CA 1.481 1.083 0 O-C-N 121.459 -0.775 . . . . 0.0 112.444 174.58 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -76.45 -9.08 86.08 Favored Glycine 0 CA--C 1.539 1.536 0 C-N-CA 125.435 1.493 . . . . 0.0 115.042 176.623 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 9.7 mmpt? -67.19 141.41 57.33 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-N 119.477 1.639 . . . . 0.0 111.14 172.349 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 51.5 p90 -153.79 164.83 37.68 Favored 'General case' 0 C--O 1.24 0.563 0 C-N-CA 124.354 1.062 . . . . 0.0 112.27 170.854 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 6.5 m -129.74 137.15 57.43 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 C-N-CA 126.19 1.796 . . . . 0.0 108.971 169.493 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 9.2 p -66.49 134.84 29.46 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.923 0 O-C-N 121.167 -0.958 . . . . 0.0 110.043 -179.312 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 3.3 t -88.09 114.55 59.82 Favored Pre-proline 0 CA--C 1.54 0.567 0 C-N-CA 123.68 0.792 . . . . 0.0 109.112 174.564 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 95.5 Cg_endo -74.29 162.97 37.45 Favored 'Trans proline' 0 CA--C 1.534 0.503 0 C-N-CA 122.704 2.269 . . . . 0.0 112.937 -178.826 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 17.1 pt-20 -66.0 -19.56 65.9 Favored 'General case' 0 N--CA 1.477 0.904 0 O-C-N 121.318 -0.864 . . . . 0.0 113.022 172.148 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 76.7 p -80.91 -6.07 58.22 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 126.057 1.743 . . . . 0.0 113.685 172.103 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 44.1 t -60.28 148.02 38.19 Favored 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 114.333 1.234 . . . . 0.0 114.333 -179.168 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 7.2 pt20 -74.32 88.05 2.03 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.953 1.301 . . . . 0.0 111.577 170.955 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 26.6 m-20 56.33 19.28 3.88 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 126.479 1.912 . . . . 0.0 115.175 176.313 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 10.5 mtt 55.75 30.98 16.63 Favored 'General case' 0 N--CA 1.472 0.625 0 N-CA-C 115.259 1.577 . . . . 0.0 115.259 -174.217 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -133.92 139.28 46.04 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.304 1.042 . . . . 0.0 112.637 -178.713 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 5.7 t80 -154.31 159.49 41.25 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 123.361 0.665 . . . . 0.0 112.107 177.74 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -88.88 152.44 21.74 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 125.465 1.506 . . . . 0.0 114.106 -172.74 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 25.3 t -104.16 104.41 43.76 Favored Pre-proline 0 CA--C 1.547 0.863 0 C-N-CA 126.615 1.966 . . . . 0.0 109.347 166.117 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -62.16 -23.49 75.53 Favored 'Trans proline' 0 CA--C 1.54 0.803 0 C-N-CA 123.243 2.629 . . . . 0.0 115.258 178.314 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 79.0 mt -72.96 -54.52 15.59 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 C-N-CA 124.089 0.956 . . . . 0.0 111.044 -176.749 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 14.1 p -102.8 1.19 33.84 Favored 'General case' 0 CA--C 1.551 1.014 0 N-CA-C 113.807 1.04 . . . . 0.0 113.807 -178.409 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 568' ' ' LYS . . . . . . . . . . . . 0.304 0.0 OUTLIER 55.73 43.71 27.45 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 127.808 2.443 . . . . 0.0 113.688 -175.909 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 70.9 mm-40 -110.88 -177.58 3.25 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.096 0.558 . . . . 0.0 112.41 179.568 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 99.1 m -125.9 126.72 44.87 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 124.817 1.247 . . . . 0.0 111.346 177.793 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 1.2 m -87.61 144.7 8.69 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.775 0 C-N-CA 124.645 1.178 . . . . 0.0 110.61 168.681 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 51.4 p -130.63 144.1 51.19 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 124.42 1.088 . . . . 0.0 111.296 176.438 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -67.54 152.81 52.8 Favored Glycine 0 CA--C 1.535 1.294 0 C-N-CA 124.201 0.905 . . . . 0.0 113.845 179.715 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 8.9 p -137.6 142.08 37.53 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 C-N-CA 125.177 1.391 . . . . 0.0 112.14 176.345 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 75.6 t80 -77.21 123.11 25.99 Favored 'General case' 0 CA--C 1.542 0.667 0 O-C-N 120.618 -1.301 . . . . 0.0 112.984 -173.214 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 24.3 t0 -90.08 118.14 29.39 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 124.67 1.188 . . . . 0.0 111.427 169.217 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 63.2 mt-10 -71.84 -27.75 63.1 Favored 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 113.656 0.984 . . . . 0.0 113.656 -178.788 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -75.31 -50.27 16.56 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 123.797 0.839 . . . . 0.0 111.998 -178.398 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 13.0 t -74.18 -28.98 61.54 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.461 0.705 . . . . 0.0 112.268 171.933 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 76.57 29.35 58.0 Favored Glycine 0 CA--C 1.536 1.39 0 C-N-CA 123.651 0.643 . . . . 0.0 112.721 -174.905 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 79.4 mm-40 -141.65 157.48 45.03 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 125.454 1.501 . . . . 0.0 111.106 -173.154 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 75.7 m95 -79.63 146.62 32.41 Favored 'General case' 0 N--CA 1.47 0.554 0 O-C-N 121.157 -0.964 . . . . 0.0 112.007 177.359 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 8.5 m -135.05 138.89 48.22 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 C-N-CA 126.249 1.82 . . . . 0.0 112.433 -177.068 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 0.8 OUTLIER -90.4 100.21 13.09 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 126.062 1.745 . . . . 0.0 107.23 170.229 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 42.7 mtmt -75.48 150.32 38.25 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 123.861 0.864 . . . . 0.0 112.367 179.088 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 54.1 t30 51.45 40.23 26.26 Favored 'General case' 0 CA--C 1.551 1.01 0 C-N-CA 125.627 1.571 . . . . 0.0 112.43 -174.666 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 80.6 m -125.21 145.88 49.77 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 124.149 0.98 . . . . 0.0 112.895 -174.584 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 8.4 tt -142.81 148.16 20.0 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 C-N-CA 127.577 2.351 . . . . 0.0 110.743 -178.825 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 60.4 tt0 -110.38 126.15 53.97 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 125.24 1.416 . . . . 0.0 109.539 169.683 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 2.2 t -142.99 129.57 17.61 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 C-N-CA 126.322 1.849 . . . . 0.0 109.809 -177.041 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 70.1 m-20 52.78 37.09 22.97 Favored 'General case' 0 CA--C 1.551 1.01 0 C-N-CA 125.064 1.346 . . . . 0.0 114.073 174.39 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 79.59 8.21 87.91 Favored Glycine 0 CA--C 1.536 1.397 0 C-N-CA 124.853 1.216 . . . . 0.0 115.485 -179.557 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 56.6 mtmt -127.54 155.46 43.76 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 125.878 1.671 . . . . 0.0 111.408 178.029 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 65.6 m-85 -98.87 149.45 22.9 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 123.905 0.882 . . . . 0.0 112.424 175.996 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 93.5 m-85 -150.58 162.04 41.42 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 126.087 1.755 . . . . 0.0 111.547 -174.924 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 596' ' ' HIS . . . . . . . . . . . . . 18.3 m80 -74.69 141.01 44.57 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 166.935 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 9.2 t -65.09 -40.36 94.49 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 118.219 0.463 . . . . 0.0 111.504 177.471 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 21.4 p -60.67 -45.32 94.59 Favored 'General case' 0 N--CA 1.478 0.938 0 N-CA-C 114.062 1.134 . . . . 0.0 114.062 172.001 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 599' ' ' CYS . . . . . . . . . . . . . 98.9 m -62.13 -51.52 67.56 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 123.884 0.874 . . . . 0.0 111.837 177.551 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 68.5 t80 -61.27 -41.97 97.85 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 123.599 0.759 . . . . 0.0 112.012 177.659 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 23.8 t-80 -68.01 -35.14 77.79 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 123.886 0.875 . . . . 0.0 113.263 178.238 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 31.8 tp10 -69.8 -34.21 73.41 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 124.514 1.125 . . . . 0.0 112.384 172.161 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 95.8 m -70.28 -37.06 74.76 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 124.122 0.969 . . . . 0.0 111.765 173.513 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 604' ' ' SER . . . . . . . . . . . . . 52.3 m -73.23 170.1 15.69 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 126.123 1.769 . . . . 0.0 113.37 177.725 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 605' ' ' GLN . . . . . . . . . . . . . 77.0 mt-30 -136.4 163.79 29.64 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.583 1.553 . . . . 0.0 111.4 175.701 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 606' ' ' ASN . . . . . . . . . . . . . 42.6 t30 -67.16 169.18 8.98 Favored 'General case' 0 CA--C 1.554 1.108 0 C-N-CA 124.245 1.018 . . . . 0.0 111.866 171.025 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 607' ' ' SER . . . . . . . . . . . . . 30.8 t -53.8 134.11 42.41 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 124.804 1.242 . . . . 0.0 113.125 -177.297 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 608' ' ' SER . . . . . . . . . . . . . 31.4 t . . . . . 0 C--O 1.254 1.34 0 C-N-CA 126.337 1.855 . . . . 0.0 111.632 -172.963 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 533' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.628 0 N-CA-C 110.964 -0.854 . . . . 0.0 110.964 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . -80.8 -12.41 82.79 Favored Glycine 0 CA--C 1.538 1.512 0 N-CA-C 115.641 1.016 . . . . 0.0 115.641 -176.923 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 535' ' ' SER . . . . . . . . . . . . . 91.2 p -92.24 158.69 16.0 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 125.457 1.503 . . . . 0.0 113.764 -178.304 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 536' ' ' GLU . . . . . . . . . . . . . 17.2 pt-20 -93.92 11.76 28.39 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 126.115 1.766 . . . . 0.0 113.467 176.805 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 537' ' ' PHE . . . . . . . . . . . . . 10.0 m-30 -70.31 0.95 5.48 Favored 'General case' 0 CA--C 1.547 0.857 0 N-CA-C 116.595 2.072 . . . . 0.0 116.595 -167.879 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 38.2 t -149.41 -52.87 0.16 Allowed 'General case' 0 N--CA 1.478 0.927 0 CA-C-N 119.645 1.111 . . . . 0.0 113.546 174.778 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 539' ' ' ASP . . . . . . . . . . . . . 39.9 t0 52.34 43.4 30.85 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 124.665 1.186 . . . . 0.0 113.167 -178.324 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 540' ' ' ARG . . . . . . . . . . . . . 61.9 ttt180 -142.33 142.09 32.44 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 125.394 1.478 . . . . 0.0 111.941 -172.964 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 32.1 t -67.25 -28.66 68.23 Favored 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 114.553 1.316 . . . . 0.0 114.553 -169.837 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 542' ' ' ASN . . . . . . . . . . . . . 13.7 p-10 -61.03 -23.07 65.14 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 124.563 1.145 . . . . 0.0 114.087 -174.871 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -59.03 -32.21 69.53 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 124.333 1.053 . . . . 0.0 113.099 173.652 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 75.6 mt -78.48 -36.38 45.27 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 124.374 1.07 . . . . 0.0 112.415 178.613 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -67.25 -33.39 75.23 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 114.062 1.134 . . . . 0.0 114.062 -169.033 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 33.2 mm -62.94 -37.11 78.43 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.881 0 C-N-CA 123.107 0.563 . . . . 0.0 112.142 -176.912 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.16 -8.99 56.36 Favored 'General case' 0 N--CA 1.48 1.038 0 N-CA-C 113.883 1.068 . . . . 0.0 113.883 177.988 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -77.69 -12.58 84.34 Favored Glycine 0 CA--C 1.537 1.447 0 C-N-CA 124.677 1.132 . . . . 0.0 114.523 170.301 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -69.75 135.33 49.62 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 118.769 1.284 . . . . 0.0 113.003 -178.462 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 42.7 p90 -154.74 162.82 40.97 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 124.737 1.215 . . . . 0.0 112.538 169.979 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -136.07 133.03 50.43 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.581 0 C-N-CA 126.246 1.819 . . . . 0.0 109.925 179.84 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 9.9 p -67.37 138.94 21.8 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.135 0 C-N-CA 123.633 0.773 . . . . 0.0 111.64 -175.868 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 61.6 t -76.24 115.74 49.77 Favored Pre-proline 0 N--CA 1.473 0.681 0 C-N-CA 124.53 1.132 . . . . 0.0 108.752 169.835 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -79.49 157.72 25.43 Favored 'Trans proline' 0 CA--C 1.54 0.791 0 C-N-CA 122.965 2.443 . . . . 0.0 111.972 176.914 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -64.63 -24.36 67.56 Favored 'General case' 0 CA--C 1.55 0.97 0 N-CA-C 113.414 0.894 . . . . 0.0 113.414 179.897 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 37.4 p -69.04 -37.36 78.55 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 125.557 1.543 . . . . 0.0 112.453 174.399 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 60.9 m -79.85 59.88 3.29 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.001 1.321 . . . . 0.0 111.046 171.267 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -65.7 -17.15 64.4 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 124.928 1.291 . . . . 0.0 114.131 -170.276 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 70.2 m-20 -73.85 -17.93 61.0 Favored 'General case' 0 N--CA 1.479 1.011 0 O-C-N 120.902 -1.124 . . . . 0.0 113.142 169.59 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 37.9 mtp 57.29 25.27 10.94 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 127.479 2.311 . . . . 0.0 115.102 176.886 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -140.96 152.82 45.28 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 124.319 1.048 . . . . 0.0 113.34 -175.073 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -156.1 160.66 40.14 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 126.45 1.9 . . . . 0.0 110.009 175.736 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 77.6 tttt -100.77 151.63 21.45 Favored 'General case' 0 N--CA 1.48 1.069 0 O-C-N 121.07 -1.019 . . . . 0.0 112.942 -179.455 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 49.0 t -92.22 110.27 43.33 Favored Pre-proline 0 CA--C 1.545 0.765 0 C-N-CA 127.374 2.27 . . . . 0.0 109.431 169.249 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -62.37 -15.37 44.63 Favored 'Trans proline' 0 CA--C 1.541 0.833 0 C-N-CA 123.919 3.08 . . . . 0.0 116.052 175.81 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 96.8 mt -80.05 -62.18 1.49 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.893 0 CA-C-N 119.311 0.959 . . . . 0.0 110.779 -179.239 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 14.7 p -96.96 -0.22 47.81 Favored 'General case' 0 CA--C 1.544 0.75 0 N-CA-C 113.947 1.092 . . . . 0.0 113.947 -177.521 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 568' ' ' LYS . . . . . . . . . . . . . 11.0 mptt 60.83 46.03 9.19 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 127.626 2.371 . . . . 0.0 111.707 -179.773 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 65.9 mm-40 -124.05 142.1 51.47 Favored 'General case' 0 N--CA 1.484 1.257 0 N-CA-C 114.947 1.462 . . . . 0.0 114.947 -175.085 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 88.4 m -87.71 122.41 31.35 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.794 0.838 . . . . 0.0 112.714 -177.42 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 2.9 m -81.98 151.13 4.27 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 C-N-CA 124.554 1.142 . . . . 0.0 110.007 167.243 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 57.6 p -131.96 147.97 52.49 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 124.728 1.211 . . . . 0.0 110.766 173.64 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -64.62 144.04 47.76 Favored Glycine 0 N--CA 1.468 0.825 0 C-N-CA 124.041 0.829 . . . . 0.0 113.775 -179.564 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 67.7 t -135.38 128.46 48.31 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.446 0 C-N-CA 125.575 1.55 . . . . 0.0 111.248 -179.52 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 88.3 t80 -67.59 115.72 7.5 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 121.687 -0.633 . . . . 0.0 112.278 -178.803 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -82.2 121.13 26.23 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 124.126 0.971 . . . . 0.0 110.234 169.888 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 53.0 mt-10 -70.72 -36.27 73.12 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.715 1.206 . . . . 0.0 113.841 -169.572 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -88.92 -33.93 17.1 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 119.041 0.837 . . . . 0.0 113.159 -178.586 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 19.3 m -72.24 -30.58 65.02 Favored 'General case' 0 N--CA 1.476 0.858 0 CA-C-N 118.421 0.555 . . . . 0.0 111.512 169.793 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 75.14 28.73 61.65 Favored Glycine 0 CA--C 1.535 1.289 0 C-N-CA 125.539 1.543 . . . . 0.0 113.562 -177.3 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 75.0 mm-40 -144.89 148.15 33.58 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 124.394 1.078 . . . . 0.0 112.246 -169.814 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 83.8 m95 -75.35 134.65 40.94 Favored 'General case' 0 C--N 1.327 -0.408 0 O-C-N 121.187 -0.946 . . . . 0.0 110.996 177.91 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 17.6 m -137.11 152.25 27.92 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 C-N-CA 126.359 1.864 . . . . 0.0 112.112 -173.704 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 5.8 m0 -93.96 102.64 14.74 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 126.011 1.724 . . . . 0.0 108.171 170.781 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 72.9 mmtt -78.12 145.44 35.73 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 124.408 1.083 . . . . 0.0 111.944 -178.431 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 60.08 37.64 20.93 Favored 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 125.097 1.359 . . . . 0.0 111.602 -175.691 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 26.8 m -128.7 149.02 50.86 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 124.783 1.233 . . . . 0.0 112.285 -171.222 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 17.3 tt -135.48 144.86 32.78 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 C-N-CA 127.507 2.323 . . . . 0.0 110.208 178.151 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 71.9 tt0 -106.15 125.63 51.23 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.478 1.111 . . . . 0.0 109.783 169.232 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 7.7 p -152.4 134.45 5.9 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.712 0 C-N-CA 124.589 1.155 . . . . 0.0 111.318 -175.826 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 70.9 m-20 53.27 35.29 19.73 Favored 'General case' 0 CA--C 1.553 1.093 0 C-N-CA 124.875 1.27 . . . . 0.0 114.266 -178.648 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 79.99 6.88 88.95 Favored Glycine 0 CA--C 1.538 1.529 0 C-N-CA 124.947 1.261 . . . . 0.0 115.64 179.727 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -130.43 158.39 40.03 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 125.388 1.475 . . . . 0.0 112.363 -179.383 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 78.3 m-85 -92.62 149.48 21.31 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-O 122.049 0.928 . . . . 0.0 113.02 176.222 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 77.2 m-85 -152.12 159.98 43.52 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 126.371 1.868 . . . . 0.0 109.746 -176.43 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 596' ' ' HIS . . . . . . . . . . . . . 28.8 m80 -76.76 140.2 40.69 Favored 'General case' 0 N--CA 1.473 0.694 0 O-C-N 120.915 -1.116 . . . . 0.0 108.369 167.82 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 53.1 p -63.76 -40.17 96.05 Favored 'General case' 0 N--CA 1.469 0.513 0 O-C-N 121.732 -0.605 . . . . 0.0 112.254 -177.74 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 7.2 p -69.39 -42.28 75.34 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 124.743 1.217 . . . . 0.0 113.157 174.844 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 599' ' ' CYS . . . . . . . . . . . . . 77.4 m -57.45 -54.95 41.05 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.304 1.042 . . . . 0.0 110.896 174.052 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 61.9 t80 -55.49 -49.01 73.66 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 124.09 0.956 . . . . 0.0 111.889 178.44 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 86.3 t60 -63.21 -40.32 97.15 Favored 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 113.114 0.783 . . . . 0.0 113.114 -178.795 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -71.45 -37.89 71.37 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 123.855 0.862 . . . . 0.0 112.657 176.83 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 91.6 m -86.02 -31.93 21.75 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 124.321 1.048 . . . . 0.0 113.549 -171.651 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 604' ' ' SER . . . . . . . . . . . . . 34.2 t -64.26 122.31 16.35 Favored 'General case' 0 N--CA 1.469 0.501 0 O-C-N 121.47 -0.769 . . . . 0.0 112.016 -177.616 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 605' ' ' GLN . . . . . . . . . . . . . 2.0 tm0? -78.94 144.07 35.18 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.541 1.136 . . . . 0.0 111.736 179.41 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 606' ' ' ASN . . . . . . . . . . . . . 80.6 m-20 -67.8 -28.64 67.77 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 124.126 0.97 . . . . 0.0 113.16 175.464 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 607' ' ' SER . . . . . . . . . . . . . 6.0 t 58.69 -165.32 0.18 Allowed 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 125.872 1.669 . . . . 0.0 113.468 -178.08 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 608' ' ' SER . . . . . . . . . . . . . 80.5 p . . . . . 0 C--O 1.253 1.241 0 C-N-CA 125.821 1.648 . . . . 0.0 114.541 179.554 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 18.0 mm . . . . . 0 N--CA 1.475 0.808 0 CA-C-O 120.74 0.305 . . . . 0.0 110.914 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 8.1 tmm_? -76.49 -23.83 53.79 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.919 1.288 . . . . 0.0 112.815 -177.243 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -71.45 -12.04 72.72 Favored Glycine 0 CA--C 1.541 1.689 0 C-N-CA 124.721 1.153 . . . . 0.0 115.579 175.941 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 71.8 mmtt -68.23 152.54 45.31 Favored 'General case' 0 N--CA 1.476 0.864 0 CA-C-N 119.108 1.454 . . . . 0.0 112.79 178.787 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 51.1 p90 -154.82 166.12 34.47 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 124.867 1.267 . . . . 0.0 112.629 172.796 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 1.6 m -135.35 140.2 45.32 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.885 0 C-N-CA 126.326 1.851 . . . . 0.0 110.294 175.767 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 78.8 t -69.07 130.9 34.22 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.232 0 O-C-N 121.297 -0.877 . . . . 0.0 111.278 -177.462 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 553' ' ' VAL . . . . . 0.458 HG22 ' CD2' ' A' ' 584' ' ' TRP . 11.2 t -79.26 122.44 84.16 Favored Pre-proline 0 CA--C 1.541 0.602 0 C-N-CA 124.183 0.993 . . . . 0.0 110.01 172.286 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -75.8 156.39 39.46 Favored 'Trans proline' 0 CA--C 1.537 0.663 0 C-N-CA 122.56 2.173 . . . . 0.0 112.251 176.484 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 15.7 pm0 -66.43 -17.25 64.68 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 124.295 1.038 . . . . 0.0 113.493 174.205 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 74.2 p -81.34 -9.28 59.78 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 125.891 1.677 . . . . 0.0 113.06 172.726 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 43.9 t -59.79 141.15 55.84 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 119.293 0.951 . . . . 0.0 113.225 179.451 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 88.3 mm-40 -75.11 97.13 3.38 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 124.115 0.966 . . . . 0.0 110.132 173.02 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 30.0 m-20 55.25 25.62 7.57 Favored 'General case' 0 CA--C 1.554 1.107 0 C-N-CA 126.288 1.835 . . . . 0.0 114.808 177.937 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 8.1 mtt 57.32 32.99 22.65 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 125.6 1.56 . . . . 0.0 114.707 179.391 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -137.8 149.4 46.34 Favored 'General case' 0 CA--C 1.538 0.489 0 N-CA-C 115.058 1.503 . . . . 0.0 115.058 -173.39 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 24.5 m-85 -149.25 165.68 31.19 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 127.34 2.256 . . . . 0.0 110.014 171.322 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 19.7 ttmm -117.95 133.9 55.47 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 123.928 0.891 . . . . 0.0 112.317 -179.092 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 14.4 t -73.59 111.73 13.26 Favored Pre-proline 0 CA--C 1.547 0.856 0 C-N-CA 127.045 2.138 . . . . 0.0 110.483 170.487 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 79.9 Cg_endo -70.64 -15.41 33.79 Favored 'Trans proline' 0 CA--C 1.542 0.913 0 C-N-CA 122.728 2.285 . . . . 0.0 114.132 175.936 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 93.0 mt -73.7 -56.12 10.33 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.823 0 C-N-CA 124.307 1.043 . . . . 0.0 110.924 -178.866 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 13.8 p -102.38 -1.68 30.36 Favored 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 124.752 1.221 . . . . 0.0 113.901 -179.816 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 568' ' ' LYS . . . . . . . . . . . . . 33.1 mmtp 62.65 41.67 9.08 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 127.072 2.149 . . . . 0.0 113.462 -178.173 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 75.0 mm-40 -122.76 145.62 48.25 Favored 'General case' 0 N--CA 1.482 1.175 0 N-CA-C 113.841 1.052 . . . . 0.0 113.841 -174.251 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 28.0 m -94.16 121.06 35.28 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.661 0.784 . . . . 0.0 111.463 -173.798 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 4.8 m -80.2 148.65 5.6 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.675 0 C-N-CA 124.62 1.168 . . . . 0.0 111.358 168.943 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 45.5 p -132.69 144.46 50.32 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 124.93 1.292 . . . . 0.0 111.193 174.843 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -67.31 152.17 52.59 Favored Glycine 0 CA--C 1.539 1.563 0 C-N-CA 124.419 1.009 . . . . 0.0 113.94 176.978 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 46.3 t -133.19 137.74 52.83 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.956 0 C-N-CA 125.937 1.695 . . . . 0.0 111.108 178.591 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 33.3 t80 -69.95 140.92 53.09 Favored 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 114.51 1.3 . . . . 0.0 114.51 -173.898 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 40.1 t0 -114.33 108.5 17.0 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 127.341 2.257 . . . . 0.0 110.469 170.858 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -66.23 -27.5 68.02 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 114.317 1.229 . . . . 0.0 114.317 -179.461 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -74.92 -50.76 15.73 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-N 118.994 0.815 . . . . 0.0 112.09 -176.79 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 25.3 t -77.52 -31.95 53.76 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 123.452 0.701 . . . . 0.0 111.704 174.255 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 81.92 29.53 38.07 Favored Glycine 0 CA--C 1.53 1.012 0 C-N-CA 124.011 0.815 . . . . 0.0 112.201 -173.991 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 80.0 mm-40 -129.61 -174.08 3.2 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 126.529 1.932 . . . . 0.0 110.156 -176.422 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 53.8 m95 -117.99 156.63 28.21 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.458 1.103 . . . . 0.0 110.986 178.815 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 17.7 m -137.62 140.36 41.57 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 C-N-CA 125.505 1.522 . . . . 0.0 112.816 -177.473 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 584' ' ' TRP . . . . . 0.458 ' CD2' HG22 ' A' ' 553' ' ' VAL . 1.1 m0 -90.95 105.6 17.94 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 126.575 1.95 . . . . 0.0 108.682 173.697 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 30.8 mmmt -72.27 142.52 48.91 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 125.144 1.378 . . . . 0.0 111.239 -177.91 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 57.9 t30 51.2 39.45 23.7 Favored 'General case' 0 CA--C 1.553 1.078 0 C-N-CA 125.633 1.573 . . . . 0.0 113.496 -177.247 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 89.7 m -124.01 149.63 45.8 Favored 'General case' 0 N--CA 1.482 1.129 0 O-C-N 120.629 -1.295 . . . . 0.0 112.966 -170.931 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 10.4 tt -141.51 137.27 32.4 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.636 0 C-N-CA 127.326 2.25 . . . . 0.0 110.638 178.909 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 77.5 tt0 -107.19 137.18 45.74 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 125.295 1.438 . . . . 0.0 109.664 169.715 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 7.6 p -151.71 123.29 1.06 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 C-N-CA 124.789 1.236 . . . . 0.0 110.847 179.084 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 35.3 m120 49.09 41.31 19.21 Favored 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 125.914 1.685 . . . . 0.0 114.11 174.433 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 85.97 1.41 86.85 Favored Glycine 0 CA--C 1.536 1.378 0 N-CA-C 116.071 1.189 . . . . 0.0 116.071 179.48 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -114.42 153.09 30.51 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 125.662 1.585 . . . . 0.0 111.984 177.469 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 42.0 m-85 -112.35 145.04 40.78 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 125.237 1.415 . . . . 0.0 111.937 177.8 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 99.1 m-85 -152.41 164.84 36.72 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 125.161 1.384 . . . . 0.0 111.541 -176.795 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 596' ' ' HIS . . . . . 0.426 ' HB2' ' HB2' ' A' ' 599' ' ' CYS . 21.4 m80 -78.15 144.51 36.35 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 166.501 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 19.5 t -64.16 -44.99 90.41 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 118.419 0.554 . . . . 0.0 111.365 178.29 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 22.8 p -64.09 -34.98 79.28 Favored 'General case' 0 N--CA 1.479 1.004 0 N-CA-C 114.016 1.117 . . . . 0.0 114.016 175.358 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 599' ' ' CYS . . . . . 0.426 ' HB2' ' HB2' ' A' ' 596' ' ' HIS . 87.9 m -71.53 -54.74 9.53 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 123.84 0.856 . . . . 0.0 111.22 176.226 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 70.7 t80 -61.04 -34.99 75.73 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 123.587 0.755 . . . . 0.0 112.606 -178.996 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 82.7 t60 -55.7 -31.88 62.83 Favored 'General case' 0 CA--C 1.543 0.688 0 O-C-N 121.167 -0.958 . . . . 0.0 113.554 176.394 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -73.27 -25.2 60.59 Favored 'General case' 0 CA--C 1.548 0.888 0 O-C-N 121.203 -0.935 . . . . 0.0 113.387 174.532 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 44.0 p . . . . . 0 N--CA 1.481 1.124 0 C-N-CA 125.384 1.474 . . . . 0.0 114.429 -175.439 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 12.0 mm . . . . . 0 N--CA 1.476 0.828 0 CA-C-O 120.467 0.175 . . . . 0.0 110.736 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 95.6 mtt-85 -77.84 -25.88 49.04 Favored 'General case' 0 N--CA 1.48 1.049 0 O-C-N 121.027 -1.046 . . . . 0.0 113.399 178.381 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -69.59 -9.01 61.08 Favored Glycine 0 CA--C 1.537 1.417 0 C-N-CA 125.537 1.541 . . . . 0.0 115.087 176.026 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -63.04 149.82 44.07 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-N 118.513 1.156 . . . . 0.0 111.714 170.744 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 45.6 p90 -156.44 166.61 32.93 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.205 1.002 . . . . 0.0 112.373 176.039 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 12.0 m -129.7 140.32 49.35 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 C-N-CA 126.299 1.84 . . . . 0.0 109.258 169.448 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 48.4 t -71.45 128.58 34.72 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.106 0 O-C-N 121.16 -0.963 . . . . 0.0 110.006 -177.225 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 553' ' ' VAL . . . . . 0.479 HG22 ' CD2' ' A' ' 584' ' ' TRP . 4.0 t -79.72 126.37 80.51 Favored Pre-proline 0 CA--C 1.538 0.498 0 C-N-CA 123.78 0.832 . . . . 0.0 109.001 171.169 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -66.82 145.15 73.9 Favored 'Trans proline' 0 CA--C 1.538 0.698 0 C-N-CA 122.734 2.289 . . . . 0.0 112.248 -177.975 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 17.1 pt-20 -63.14 -17.13 62.01 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 113.49 0.922 . . . . 0.0 113.49 175.991 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 10.7 m -66.08 -30.86 71.45 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 125.436 1.494 . . . . 0.0 112.002 171.729 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 28.7 t -81.01 130.84 35.2 Favored 'General case' 0 N--CA 1.472 0.643 0 O-C-N 121.632 -0.668 . . . . 0.0 111.684 174.062 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 2.6 pm0 -101.8 -25.8 13.69 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.692 1.597 . . . . 0.0 112.203 169.08 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 87.3 m-20 -77.41 -38.08 50.52 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 124.456 1.103 . . . . 0.0 112.924 179.781 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 8.7 mtt 51.46 36.01 15.69 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.694 1.597 . . . . 0.0 115.131 175.284 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -131.74 146.55 52.22 Favored 'General case' 0 CA--C 1.54 0.558 0 N-CA-C 114.057 1.132 . . . . 0.0 114.057 -173.95 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 2.8 t80 -153.98 179.66 8.7 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 125.749 1.62 . . . . 0.0 110.38 173.57 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 22.9 ttmm -135.05 138.16 43.62 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 124.434 1.094 . . . . 0.0 113.038 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 26.4 t -71.62 116.75 50.94 Favored Pre-proline 0 CA--C 1.539 0.544 0 C-N-CA 126.301 1.84 . . . . 0.0 110.198 170.271 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo -72.65 -17.68 26.04 Favored 'Trans proline' 0 CA--C 1.543 0.951 0 C-N-CA 122.859 2.373 . . . . 0.0 113.581 176.3 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 90.7 mt -73.02 -55.35 13.09 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 CA-C-N 119.803 1.183 . . . . 0.0 110.953 -178.547 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 14.9 p -103.35 2.76 34.44 Favored 'General case' 0 CA--C 1.553 1.062 0 C-N-CA 124.566 1.146 . . . . 0.0 113.494 -179.242 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 568' ' ' LYS . . . . . . . . . . . . 0.335 64.1 pttt 56.0 42.92 28.01 Favored 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 127.083 2.153 . . . . 0.0 113.608 -177.63 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 69.8 mm-40 -119.6 137.81 53.63 Favored 'General case' 0 N--CA 1.483 1.207 0 N-CA-C 114.803 1.409 . . . . 0.0 114.803 -174.666 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 49.9 m -74.37 140.55 44.86 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 124.679 1.192 . . . . 0.0 112.992 -178.214 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -114.84 145.51 20.5 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.617 0 C-N-CA 126.576 1.95 . . . . 0.0 110.86 168.948 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 44.6 p -133.31 141.53 48.01 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.601 1.16 . . . . 0.0 111.794 178.752 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -70.6 147.32 43.47 Favored Glycine 0 CA--C 1.534 1.236 0 C-N-CA 124.709 1.147 . . . . 0.0 113.615 -179.637 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 71.8 t -130.03 141.98 44.98 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 C-N-CA 125.318 1.447 . . . . 0.0 111.139 -179.737 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 62.0 t80 -65.41 131.33 46.16 Favored 'General case' 0 CA--C 1.544 0.742 0 CA-C-O 121.828 0.823 . . . . 0.0 112.725 -175.931 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 49.9 t0 -96.03 99.39 11.15 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 126.723 2.009 . . . . 0.0 111.391 174.061 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 69.0 mt-10 -66.34 -21.79 66.25 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 124.746 1.219 . . . . 0.0 113.958 179.776 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 36.7 tp10 -72.96 -34.66 66.64 Favored 'General case' 0 CA--C 1.542 0.645 0 O-C-N 120.499 -1.376 . . . . 0.0 113.103 -176.54 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 63.7 m -124.13 -13.13 7.33 Favored 'General case' 0 N--CA 1.474 0.749 0 N-CA-C 114.853 1.427 . . . . 0.0 114.853 -178.969 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 84.08 33.14 21.57 Favored Glycine 0 CA--C 1.531 1.055 0 C-N-CA 124.309 0.957 . . . . 0.0 113.209 176.209 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -121.83 -162.63 1.0 Allowed 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 125.14 1.376 . . . . 0.0 109.769 -178.488 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 62.8 m95 -129.18 155.08 46.09 Favored 'General case' 0 CA--C 1.533 0.302 0 O-C-N 121.116 -0.99 . . . . 0.0 111.465 175.431 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 16.2 m -139.37 134.03 39.54 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 C-N-CA 124.788 1.235 . . . . 0.0 112.933 -173.86 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 584' ' ' TRP . . . . . 0.479 ' CD2' HG22 ' A' ' 553' ' ' VAL . 1.0 OUTLIER -86.46 96.91 10.2 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 126.618 1.967 . . . . 0.0 108.331 169.748 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 67.3 mttm -74.34 149.75 40.44 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 124.674 1.19 . . . . 0.0 111.841 -179.838 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 64.79 0.62 1.2 Allowed 'General case' 0 CA--C 1.56 1.331 0 C-N-CA 126.805 2.042 . . . . 0.0 113.895 -172.269 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 54.0 m -94.91 149.05 21.66 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 125.622 1.569 . . . . 0.0 113.658 -171.186 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 14.4 tt -136.65 146.39 28.72 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.63 0 C-N-CA 127.834 2.454 . . . . 0.0 110.262 172.863 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 73.3 tt0 -108.3 126.87 53.33 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 124.632 1.173 . . . . 0.0 110.908 170.74 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 7.7 p -154.12 135.95 5.92 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 C-N-CA 124.951 1.3 . . . . 0.0 111.199 -177.441 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 71.9 m-20 52.54 38.28 25.27 Favored 'General case' 0 CA--C 1.552 1.057 0 C-N-CA 125.177 1.391 . . . . 0.0 113.666 -179.43 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 76.54 11.04 85.54 Favored Glycine 0 CA--C 1.535 1.305 0 C-N-CA 125.33 1.443 . . . . 0.0 115.62 178.438 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 56.8 mtmt -133.01 155.13 49.75 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 125.653 1.581 . . . . 0.0 111.907 -178.312 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 69.9 m-85 -92.48 147.2 23.09 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 124.271 1.028 . . . . 0.0 112.321 175.234 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 90.1 m-85 -152.21 171.12 18.43 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 126.554 1.942 . . . . 0.0 110.241 -174.432 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 596' ' ' HIS . . . . . . . . . . . . . 17.4 m80 -89.8 140.56 29.47 Favored 'General case' 0 N--CA 1.471 0.581 0 O-C-N 121.31 -0.869 . . . . 0.0 109.273 167.54 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 67.6 m -60.14 -41.72 93.31 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 123.391 0.676 . . . . 0.0 112.113 176.724 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 5.6 p -64.81 -42.73 94.77 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 124.977 1.311 . . . . 0.0 112.575 175.981 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 599' ' ' CYS . . . . . . . . . . . . . 90.8 m -65.57 -51.65 58.23 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 124.283 1.033 . . . . 0.0 111.108 177.147 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 83.7 t80 -57.84 -35.1 70.44 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 123.718 0.807 . . . . 0.0 112.608 178.064 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 1.7 m-70 -64.94 -21.63 66.86 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 114.352 1.241 . . . . 0.0 114.352 174.465 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 74.7 mt-10 -90.52 -34.15 15.66 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 119.369 0.986 . . . . 0.0 113.275 171.272 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 69.0 p . . . . . 0 N--CA 1.482 1.127 0 N-CA-C 114.542 1.312 . . . . 0.0 114.542 -175.057 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 30.1 mm . . . . . 0 CA--C 1.539 0.548 0 N-CA-C 110.519 -0.178 . . . . 0.0 110.519 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -74.31 -22.41 59.28 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 124.216 1.007 . . . . 0.0 113.219 176.416 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -72.61 -13.58 77.9 Favored Glycine 0 CA--C 1.537 1.416 0 C-N-CA 124.709 1.147 . . . . 0.0 115.085 174.941 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -69.08 143.05 54.33 Favored 'General case' 0 N--CA 1.476 0.826 0 CA-C-N 118.272 1.036 . . . . 0.0 111.909 176.882 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 54.8 p90 -151.74 164.5 36.86 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 124.545 1.138 . . . . 0.0 112.634 173.718 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 10.6 m -130.48 139.99 49.94 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 C-N-CA 126.491 1.917 . . . . 0.0 109.07 169.613 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 9.2 p -72.29 136.95 24.54 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.048 0 O-C-N 120.871 -1.143 . . . . 0.0 111.151 -175.781 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 11.9 t -84.06 120.06 74.24 Favored Pre-proline 0 N--CA 1.469 0.519 0 C-N-CA 124.122 0.969 . . . . 0.0 108.534 171.264 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 90.6 Cg_endo -73.56 156.76 49.44 Favored 'Trans proline' 0 CA--C 1.539 0.745 0 C-N-CA 122.724 2.283 . . . . 0.0 112.278 177.782 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -61.26 -24.17 66.19 Favored 'General case' 0 N--CA 1.482 1.168 0 O-C-N 121.473 -0.767 . . . . 0.0 112.656 175.069 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 67.8 p -74.08 -19.91 60.45 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 125.433 1.493 . . . . 0.0 114.136 176.181 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 4.1 m -75.54 95.39 3.31 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 119.073 0.851 . . . . 0.0 110.4 172.959 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 29.0 mt-30 -58.0 -43.17 86.46 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 125.457 1.503 . . . . 0.0 114.022 -169.846 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 63.6 m-20 -94.99 -12.04 27.4 Favored 'General case' 0 CA--C 1.545 0.786 0 N-CA-C 114.185 1.18 . . . . 0.0 114.185 -176.412 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 7.8 mtt 51.4 31.19 6.95 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 126.135 1.774 . . . . 0.0 113.787 -170.982 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -128.08 148.78 50.58 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.294 1.437 . . . . 0.0 112.256 -178.076 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -150.99 171.84 16.65 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 125.256 1.422 . . . . 0.0 109.761 176.186 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 563' ' ' LYS . . . . . . . . . . . . 0.292 0.0 OUTLIER -117.84 156.84 27.68 Favored 'General case' 0 N--CA 1.479 0.979 0 N-CA-C 114.715 1.376 . . . . 0.0 114.715 178.795 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 23.9 t -98.3 109.09 50.9 Favored Pre-proline 0 CA--C 1.539 0.519 0 C-N-CA 127.897 2.479 . . . . 0.0 109.999 169.803 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -62.33 -19.63 67.73 Favored 'Trans proline' 0 C--N 1.352 0.724 0 C-N-CA 123.148 2.565 . . . . 0.0 115.206 174.503 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 90.1 mt -73.78 -61.51 1.67 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.908 0 CA-C-N 119.455 1.025 . . . . 0.0 110.74 -178.756 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 15.7 p -96.19 -0.39 50.02 Favored 'General case' 0 CA--C 1.548 0.888 0 N-CA-C 114.126 1.158 . . . . 0.0 114.126 -177.335 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 568' ' ' LYS . . . . . . . . . . . . . 47.0 mmtm 58.59 46.14 15.14 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 125.904 1.682 . . . . 0.0 112.053 -176.684 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 53.2 mm-40 -117.8 161.12 20.24 Favored 'General case' 0 N--CA 1.484 1.249 0 N-CA-C 113.783 1.031 . . . . 0.0 113.783 -177.057 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 58.4 m -102.82 127.58 49.94 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 124.012 0.925 . . . . 0.0 112.442 -179.134 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 3.1 m -91.46 149.29 4.14 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 C-N-CA 124.651 1.18 . . . . 0.0 110.556 167.901 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 43.8 p -132.45 142.06 49.09 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 125.111 1.364 . . . . 0.0 110.585 174.888 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -67.25 152.49 52.73 Favored Glycine 0 CA--C 1.528 0.891 0 C-N-CA 124.092 0.853 . . . . 0.0 113.489 179.195 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 57.4 t -133.65 133.1 57.23 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.858 0 C-N-CA 125.253 1.421 . . . . 0.0 111.629 176.822 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 44.8 t80 -70.12 128.18 35.39 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 114.052 1.13 . . . . 0.0 114.052 -173.051 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 13.4 t0 -98.02 114.05 26.09 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 125.365 1.466 . . . . 0.0 109.02 168.409 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 9.7 mp0 -72.83 -27.24 61.83 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 114.242 1.201 . . . . 0.0 114.242 -173.95 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -83.26 -44.38 15.02 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 123.904 0.881 . . . . 0.0 112.058 179.869 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 59.8 m -71.85 -30.22 65.22 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.21 0.604 . . . . 0.0 112.249 171.884 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 77.4 26.37 61.56 Favored Glycine 0 CA--C 1.534 1.227 0 C-N-CA 124.797 1.189 . . . . 0.0 112.978 -177.905 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 55.0 mt-10 -142.43 150.94 41.26 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 125.598 1.559 . . . . 0.0 110.434 -171.49 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 43.3 m95 -84.67 151.78 24.22 Favored 'General case' 0 CA--C 1.543 0.677 0 O-C-N 121.204 -0.935 . . . . 0.0 111.23 179.629 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 17.3 m -134.39 139.35 48.15 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.31 0 C-N-CA 125.227 1.411 . . . . 0.0 112.792 -176.482 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 2.6 m0 -89.64 100.8 13.53 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 126.399 1.88 . . . . 0.0 107.855 171.27 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 53.2 mtmt -78.76 157.96 28.37 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 124.395 1.078 . . . . 0.0 112.024 179.809 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 9.1 t30 54.58 30.7 13.64 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 125.265 1.426 . . . . 0.0 113.047 -174.227 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 86.1 m -122.52 148.12 45.55 Favored 'General case' 0 N--CA 1.48 1.036 0 O-C-N 121.0 -1.063 . . . . 0.0 112.15 -169.774 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 15.6 tt -138.25 142.35 35.61 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 C-N-CA 127.313 2.245 . . . . 0.0 110.973 178.664 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 77.8 tt0 -102.96 127.27 50.25 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.457 1.103 . . . . 0.0 110.224 169.388 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 7.6 p -152.67 133.24 4.28 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 C-N-CA 125.113 1.365 . . . . 0.0 110.819 -178.971 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 74.9 m-20 53.96 41.71 31.93 Favored 'General case' 0 CA--C 1.551 0.986 0 C-N-CA 124.801 1.24 . . . . 0.0 113.104 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 73.7 11.26 80.61 Favored Glycine 0 CA--C 1.536 1.396 0 C-N-CA 124.813 1.197 . . . . 0.0 115.551 179.141 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 36.3 mtmm -134.96 156.13 49.55 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 126.341 1.857 . . . . 0.0 111.849 -173.418 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 75.9 m-85 -100.03 146.13 27.1 Favored 'General case' 0 N--CA 1.464 0.25 0 C-N-CA 124.364 1.066 . . . . 0.0 113.282 179.412 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 86.5 m-85 -151.76 165.9 33.0 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 126.592 1.957 . . . . 0.0 110.366 -173.913 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 596' ' ' HIS . . . . . 0.424 ' HB2' ' HB2' ' A' ' 599' ' ' CYS . 20.7 m80 -81.09 142.97 32.78 Favored 'General case' 0 N--CA 1.468 0.44 0 O-C-N 121.381 -0.824 . . . . 0.0 109.491 168.77 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 66.9 p -60.88 -44.79 96.59 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 123.919 0.888 . . . . 0.0 111.681 176.942 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 18.7 p -63.99 -44.7 91.89 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 125.023 1.329 . . . . 0.0 112.93 175.322 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 599' ' ' CYS . . . . . 0.424 ' HB2' ' HB2' ' A' ' 596' ' ' HIS . 97.5 m -60.97 -45.47 94.63 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.587 1.155 . . . . 0.0 111.792 178.605 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 84.2 t80 -72.95 -32.17 65.07 Favored 'General case' 0 CA--C 1.546 0.804 0 N-CA-C 113.382 0.882 . . . . 0.0 113.382 177.556 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 57.4 t-80 -75.16 -81.67 0.07 Allowed 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 114.706 1.373 . . . . 0.0 114.706 -174.178 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -95.93 -6.96 37.89 Favored 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 113.616 0.969 . . . . 0.0 113.616 -174.253 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 1.5 m . . . . . 0 N--CA 1.478 0.944 0 C-N-CA 124.585 1.154 . . . . 0.0 111.996 -177.975 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 11.2 mm . . . . . 0 CA--C 1.541 0.599 0 N-CA-C 110.297 -0.26 . . . . 0.0 110.297 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 79.7 ttt180 -65.94 -28.92 69.28 Favored 'General case' 0 N--CA 1.478 0.927 0 O-C-N 121.125 -0.984 . . . . 0.0 112.173 -179.202 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -71.96 -7.55 66.65 Favored Glycine 0 CA--C 1.542 1.734 0 C-N-CA 124.706 1.146 . . . . 0.0 115.428 175.061 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 41.8 mmtm -70.3 144.66 51.67 Favored 'General case' 0 N--CA 1.479 0.996 0 CA-C-N 119.771 1.786 . . . . 0.0 111.227 177.858 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 40.2 p90 -149.29 166.47 28.86 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 113.937 1.088 . . . . 0.0 113.937 178.198 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 4.8 m -136.74 138.84 45.8 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.841 0 C-N-CA 126.801 2.04 . . . . 0.0 109.73 174.992 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 44.0 t -70.29 133.98 30.88 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 O-C-N 121.084 -1.01 . . . . 0.0 110.998 -177.972 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 3.1 t -91.88 124.31 60.63 Favored Pre-proline 0 N--CA 1.471 0.591 0 C-N-CA 124.273 1.029 . . . . 0.0 111.639 178.198 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 62.1 Cg_endo -80.48 152.46 20.32 Favored 'Trans proline' 0 CA--C 1.538 0.714 0 C-N-CA 123.274 2.649 . . . . 0.0 111.638 169.893 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -66.77 -18.32 65.31 Favored 'General case' 0 CA--C 1.548 0.88 0 O-C-N 120.401 -1.437 . . . . 0.0 113.103 175.954 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -71.73 -22.65 61.6 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 124.877 1.271 . . . . 0.0 113.44 173.204 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 9.6 m -73.51 121.63 20.9 Favored 'General case' 0 N--CA 1.473 0.702 0 O-C-N 121.497 -0.752 . . . . 0.0 110.328 170.919 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 55.2 tp60 -53.41 116.09 2.26 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 125.077 1.351 . . . . 0.0 112.484 -168.514 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 53.31 20.95 2.1 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 126.559 1.944 . . . . 0.0 114.822 177.789 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 28.6 mtt 53.47 33.08 15.27 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 125.522 1.529 . . . . 0.0 113.443 -168.834 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -126.95 134.65 50.36 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 125.031 1.332 . . . . 0.0 112.544 -177.053 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 41.6 t80 -148.21 161.33 41.69 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 124.861 1.264 . . . . 0.0 110.041 174.948 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 3.5 ttmp? -112.67 131.26 55.73 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 123.827 0.851 . . . . 0.0 113.001 -171.996 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 22.6 t -68.11 111.77 8.8 Favored Pre-proline 0 CA--C 1.541 0.633 0 C-N-CA 126.064 1.745 . . . . 0.0 109.479 168.644 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -69.83 -17.34 37.32 Favored 'Trans proline' 0 CA--C 1.54 0.815 0 C-N-CA 122.515 2.143 . . . . 0.0 113.349 177.691 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 86.8 mt -70.28 -51.54 37.63 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.672 0 C-N-CA 124.593 1.157 . . . . 0.0 110.898 -177.706 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 14.6 p -110.75 -0.86 16.89 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 124.729 1.212 . . . . 0.0 114.071 -178.877 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 568' ' ' LYS . . . . . . . . . . . . . 34.1 mmtp 60.64 45.86 9.88 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 126.604 1.962 . . . . 0.0 113.352 -177.0 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 74.7 mt-10 -120.79 138.67 53.91 Favored 'General case' 0 N--CA 1.481 1.078 0 N-CA-C 113.746 1.017 . . . . 0.0 113.746 -175.927 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 97.1 m -83.77 121.48 27.36 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.256 0.622 . . . . 0.0 112.181 -179.234 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 1.7 m -88.11 143.65 10.82 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 C-N-CA 125.22 1.408 . . . . 0.0 110.364 168.172 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 69.1 p -124.62 142.77 51.13 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 124.971 1.309 . . . . 0.0 111.629 -179.187 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -74.97 145.55 33.8 Favored Glycine 0 CA--C 1.53 0.988 0 C-N-CA 124.302 0.953 . . . . 0.0 113.372 179.065 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 61.6 t -135.32 141.6 42.11 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.875 0 C-N-CA 125.599 1.56 . . . . 0.0 111.554 -177.336 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 62.1 t80 -70.52 127.39 32.55 Favored 'General case' 0 CA--C 1.542 0.64 0 O-C-N 121.277 -0.889 . . . . 0.0 112.976 -176.697 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 65.1 t0 -94.12 104.21 16.24 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 127.072 2.149 . . . . 0.0 109.892 170.015 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -66.89 -26.97 67.14 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.072 1.349 . . . . 0.0 114.45 -177.624 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 31.8 tp10 -78.66 -44.31 24.04 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 123.609 0.763 . . . . 0.0 111.713 -178.983 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 22.8 t -81.57 -35.32 30.37 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 124.903 1.281 . . . . 0.0 112.276 177.219 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 84.17 32.81 22.18 Favored Glycine 0 CA--C 1.53 1.031 0 C-N-CA 124.513 1.054 . . . . 0.0 113.468 -172.736 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 81.8 mm-40 -130.16 178.54 6.48 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.479 1.512 . . . . 0.0 110.705 -175.537 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 68.6 m95 -111.25 145.4 38.82 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 121.015 -1.053 . . . . 0.0 110.251 171.955 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 13.8 m -137.72 138.04 44.68 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.892 0 C-N-CA 124.985 1.314 . . . . 0.0 113.227 -172.057 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 0.8 OUTLIER -87.26 100.95 13.07 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 126.327 1.851 . . . . 0.0 107.228 169.952 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 56.7 mtmt -73.56 157.03 37.46 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 124.184 0.993 . . . . 0.0 111.253 177.093 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 55.2 33.4 20.48 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 125.307 1.443 . . . . 0.0 112.392 -176.407 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 55.2 m -130.36 147.78 52.1 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 124.71 1.204 . . . . 0.0 112.239 -169.432 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 14.7 tt -136.41 144.16 33.61 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.718 0 C-N-CA 126.978 2.111 . . . . 0.0 111.096 178.543 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -105.89 135.79 46.7 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 125.243 1.417 . . . . 0.0 110.157 168.722 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 7.5 p -147.66 123.51 2.64 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.619 0 C-N-CA 124.289 1.036 . . . . 0.0 111.006 173.88 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 69.9 m-20 51.08 36.58 15.78 Favored 'General case' 0 CA--C 1.551 1.003 0 C-N-CA 125.472 1.509 . . . . 0.0 114.245 175.402 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 89.15 -9.19 77.82 Favored Glycine 0 CA--C 1.536 1.405 0 C-N-CA 125.32 1.438 . . . . 0.0 115.633 -179.221 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 63.4 mttp -95.87 153.77 17.58 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 125.578 1.551 . . . . 0.0 111.78 176.329 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 69.1 m-85 -113.38 142.75 45.5 Favored 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 125.0 1.32 . . . . 0.0 112.259 174.485 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 16.3 m-85 -149.18 159.01 44.63 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 126.307 1.843 . . . . 0.0 110.6 -173.569 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 596' ' ' HIS . . . . . . . . . . . . . 11.8 m80 -71.31 139.13 49.81 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 106.539 -1.652 . . . . 0.0 106.539 165.555 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 72.8 p -59.3 -43.0 92.65 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 122.995 0.518 . . . . 0.0 111.935 178.603 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 14.1 p -71.59 -33.41 69.01 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 125.362 1.465 . . . . 0.0 113.693 178.144 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 599' ' ' CYS . . . . . . . . . . . . . 99.3 m -66.68 -52.46 44.57 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.657 0.783 . . . . 0.0 111.021 172.495 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 66.1 t80 -57.53 -40.67 79.32 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 123.183 0.593 . . . . 0.0 111.955 176.73 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 69.8 t60 -56.36 -46.84 79.82 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.837 1.255 . . . . 0.0 113.872 175.384 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -77.76 -23.75 49.15 Favored 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 114.044 1.127 . . . . 0.0 114.044 174.992 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 68.4 m . . . . . 0 N--CA 1.48 1.047 0 C-N-CA 124.939 1.296 . . . . 0.0 112.714 179.227 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 18.5 mm . . . . . 0 N--CA 1.476 0.831 0 CA-C-O 120.612 0.244 . . . . 0.0 111.454 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 45.0 ttt180 -61.34 -21.66 64.21 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.518 1.127 . . . . 0.0 112.879 179.442 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -71.79 -11.67 73.75 Favored Glycine 0 CA--C 1.539 1.569 0 C-N-CA 124.643 1.116 . . . . 0.0 115.251 176.03 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -69.76 146.32 51.55 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-N 119.201 1.501 . . . . 0.0 112.18 173.417 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 47.6 p90 -156.5 166.52 33.18 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 124.955 1.302 . . . . 0.0 111.772 171.59 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 2.5 m -128.93 133.5 66.0 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 C-N-CA 124.618 1.167 . . . . 0.0 109.745 170.479 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 53.3 t -68.23 132.41 32.78 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 O-C-N 121.26 -0.9 . . . . 0.0 110.113 -179.796 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 22.4 t -78.97 119.08 75.94 Favored Pre-proline 0 N--CA 1.472 0.651 0 CA-C-O 118.483 -0.77 . . . . 0.0 110.588 -179.239 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 65.3 Cg_endo -78.82 156.24 27.24 Favored 'Trans proline' 0 CA--C 1.537 0.643 0 C-N-CA 123.126 2.551 . . . . 0.0 112.15 176.84 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -67.47 -17.81 64.83 Favored 'General case' 0 N--CA 1.474 0.738 0 O-C-N 121.486 -0.759 . . . . 0.0 112.884 176.885 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 66.8 p -74.06 -22.99 59.31 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 125.02 1.328 . . . . 0.0 113.493 173.913 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 24.7 m -80.2 112.09 17.18 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 123.997 0.919 . . . . 0.0 111.683 175.258 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -62.08 136.22 57.85 Favored 'General case' 0 CA--C 1.546 0.824 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 -173.667 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 33.8 m-20 53.92 15.32 0.83 Allowed 'General case' 0 CA--C 1.553 1.073 0 C-N-CA 126.733 2.013 . . . . 0.0 115.418 176.918 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 18.9 mtt 51.35 31.93 7.78 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 125.672 1.589 . . . . 0.0 114.659 -171.494 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -123.95 142.67 50.95 Favored 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 113.851 1.056 . . . . 0.0 113.851 -174.526 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 6.5 t80 -153.91 -179.97 8.35 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 125.919 1.688 . . . . 0.0 109.963 173.378 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 18.1 ttmm -130.56 152.91 49.42 Favored 'General case' 0 N--CA 1.48 1.032 0 O-C-N 120.628 -1.295 . . . . 0.0 113.385 -175.273 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 19.2 t -95.9 107.0 31.5 Favored Pre-proline 0 CA--C 1.543 0.71 0 C-N-CA 127.865 2.466 . . . . 0.0 110.307 170.865 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_exo -62.38 -20.45 70.37 Favored 'Trans proline' 0 CA--C 1.546 1.086 0 C-N-CA 122.268 1.979 . . . . 0.0 115.736 174.71 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 88.7 mt -69.38 -52.26 34.51 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 C-N-CA 124.266 1.026 . . . . 0.0 111.35 -177.205 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 14.9 p -108.62 -0.71 20.06 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 124.328 1.051 . . . . 0.0 113.717 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 568' ' ' LYS . . . . . . . . . . . . . 95.1 mttt 59.82 44.43 13.88 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 126.966 2.106 . . . . 0.0 113.151 -177.571 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 64.8 mt-10 -112.0 138.93 47.97 Favored 'General case' 0 N--CA 1.479 0.995 0 N-CA-C 113.488 0.922 . . . . 0.0 113.488 -177.697 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 57.7 m -85.71 121.24 28.1 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 123.216 0.606 . . . . 0.0 111.037 177.778 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 3.8 m -88.4 144.15 9.76 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 C-N-CA 125.442 1.497 . . . . 0.0 110.502 170.414 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 74.6 p -128.94 144.81 51.29 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.976 1.311 . . . . 0.0 110.799 174.274 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -72.03 141.06 30.95 Favored Glycine 0 CA--C 1.525 0.677 0 C-N-CA 124.152 0.882 . . . . 0.0 112.547 -178.138 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 33.3 m -132.63 139.72 49.18 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 C-N-CA 124.497 1.119 . . . . 0.0 112.001 -178.545 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 79.2 t80 -75.32 113.69 12.99 Favored 'General case' 0 CA--C 1.54 0.589 0 O-C-N 121.4 -0.813 . . . . 0.0 111.284 179.581 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -82.3 118.21 22.97 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.371 1.068 . . . . 0.0 110.447 170.67 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 11.6 mp0 -73.87 -28.11 61.41 Favored 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 114.017 1.117 . . . . 0.0 114.017 -173.335 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 32.8 tp10 -81.52 -41.92 20.97 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.228 1.011 . . . . 0.0 111.914 -179.41 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 36.0 t -74.62 -35.88 62.93 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 125.016 1.326 . . . . 0.0 112.015 173.072 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 80.91 33.1 30.79 Favored Glycine 0 CA--C 1.534 1.246 0 C-N-CA 124.491 1.043 . . . . 0.0 113.053 -177.042 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 69.9 mm-40 -144.93 149.95 36.15 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 125.138 1.375 . . . . 0.0 111.716 -171.518 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 84.5 m95 -76.89 134.5 38.96 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 122.723 0.409 . . . . 0.0 110.555 170.032 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 8.1 m -139.41 145.05 27.71 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 C-N-CA 124.658 1.183 . . . . 0.0 113.007 -168.765 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 2.8 m0 -93.81 97.6 10.52 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 106.715 -1.587 . . . . 0.0 106.715 167.623 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 61.6 mttm -74.32 145.07 44.21 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 124.447 1.099 . . . . 0.0 111.959 -175.987 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 62.9 t30 52.16 37.12 20.91 Favored 'General case' 0 CA--C 1.551 0.994 0 C-N-CA 126.33 1.852 . . . . 0.0 113.201 -170.588 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 88.4 m -119.18 147.13 44.55 Favored 'General case' 0 N--CA 1.481 1.108 0 O-C-N 120.67 -1.269 . . . . 0.0 112.252 -176.148 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 13.2 tt -136.66 145.65 29.94 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.64 0 C-N-CA 127.888 2.475 . . . . 0.0 110.719 -178.9 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 73.5 tt0 -105.7 125.68 51.27 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.569 1.148 . . . . 0.0 110.564 169.793 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 8.3 p -158.93 145.84 7.5 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 C-N-CA 124.997 1.319 . . . . 0.0 110.655 179.876 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 53.9 t30 53.01 38.73 28.04 Favored 'General case' 0 CA--C 1.554 1.111 0 C-N-CA 124.431 1.092 . . . . 0.0 112.55 -177.996 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 65.95 14.89 61.81 Favored Glycine 0 CA--C 1.534 1.257 0 C-N-CA 125.51 1.529 . . . . 0.0 115.971 -179.844 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 35.8 mtmm -134.83 159.95 39.76 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 126.349 1.86 . . . . 0.0 110.938 -177.278 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 70.4 m-85 -91.03 149.7 21.73 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-O 121.979 0.895 . . . . 0.0 112.08 169.866 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 9.8 m-85 -145.9 165.31 29.31 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 127.283 2.233 . . . . 0.0 109.387 177.576 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 596' ' ' HIS . . . . . . . . . . . . . 26.7 m80 -77.94 141.88 38.73 Favored 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 108.161 -1.052 . . . . 0.0 108.161 166.102 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 8.4 t -65.94 -41.73 90.94 Favored 'General case' 0 N--CA 1.466 0.353 0 O-C-N 121.805 -0.559 . . . . 0.0 112.018 -177.186 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 22.3 p -64.72 -42.64 95.09 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 123.608 0.763 . . . . 0.0 112.683 173.666 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 599' ' ' CYS . . . . . . . . . . . . . 64.2 m -56.14 -58.27 8.66 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.589 1.155 . . . . 0.0 110.824 174.617 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 76.5 t80 -58.69 -46.77 86.51 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.414 0.686 . . . . 0.0 112.456 179.793 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 33.9 t-80 -58.73 -47.21 85.39 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 124.102 0.961 . . . . 0.0 113.129 -176.662 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 35.5 tp10 -77.29 -30.5 54.23 Favored 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 112.72 0.637 . . . . 0.0 112.72 -179.902 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 98.6 m . . . . . 0 N--CA 1.479 1.004 0 C-N-CA 123.761 0.825 . . . . 0.0 112.981 -176.787 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 33.9 mm . . . . . 0 CA--C 1.542 0.658 0 N-CA-C 110.847 -0.057 . . . . 0.0 110.847 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 19.0 tpp180 -68.14 -34.62 76.7 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 124.333 1.053 . . . . 0.0 111.767 175.896 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -72.61 -6.14 65.73 Favored Glycine 0 CA--C 1.537 1.424 0 C-N-CA 125.76 1.648 . . . . 0.0 115.645 177.176 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 73.4 mmtt -76.67 125.84 29.94 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-N 119.576 1.688 . . . . 0.0 110.289 171.897 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 39.5 p90 -149.29 162.89 39.15 Favored 'General case' 0 C--O 1.237 0.404 0 N-CA-C 113.277 0.843 . . . . 0.0 113.277 176.619 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -135.68 138.13 48.37 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.485 0 C-N-CA 126.274 1.83 . . . . 0.0 110.422 179.044 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 76.2 t -70.54 134.92 29.18 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.939 0 C-N-CA 123.821 0.849 . . . . 0.0 110.812 -175.61 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 72.7 t -64.96 121.79 75.87 Favored Pre-proline 0 CA--C 1.544 0.719 0 C-N-CA 124.22 1.008 . . . . 0.0 108.957 173.491 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -87.0 -9.11 6.42 Favored 'Trans proline' 0 CA--C 1.536 0.586 0 C-N-CA 124.583 3.522 . . . . 0.0 114.54 -169.144 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 63.48 -24.63 0.07 Allowed 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 127.826 2.45 . . . . 0.0 114.627 -168.408 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 80.6 p -64.53 -18.91 65.26 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 124.989 1.315 . . . . 0.0 111.995 169.333 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 33.5 p -65.56 -8.24 18.86 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 126.692 1.997 . . . . 0.0 114.184 168.493 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? 68.26 -36.78 0.32 Allowed 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 128.408 2.683 . . . . 0.0 116.644 169.751 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 28.9 t0 -125.54 14.24 8.17 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 125.167 1.387 . . . . 0.0 113.45 178.319 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 80.2 mtp 56.63 22.48 6.77 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 126.276 1.83 . . . . 0.0 114.368 -179.49 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -133.3 152.51 51.93 Favored 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 125.818 1.647 . . . . 0.0 112.012 -170.089 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 10.5 m-85 -148.82 156.43 42.33 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 125.527 1.531 . . . . 0.0 111.823 171.495 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 47.2 tttp -85.81 153.01 22.57 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 124.385 1.074 . . . . 0.0 113.248 -178.634 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 13.7 t -104.89 101.78 31.49 Favored Pre-proline 0 CA--C 1.547 0.831 0 C-N-CA 126.559 1.943 . . . . 0.0 109.128 165.017 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -61.33 -21.16 71.02 Favored 'Trans proline' 0 CA--C 1.541 0.825 0 C-N-CA 122.726 2.284 . . . . 0.0 115.496 176.76 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 89.3 mt -72.87 -58.07 5.71 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 C-N-CA 124.495 1.118 . . . . 0.0 111.658 -177.691 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 14.4 p -98.12 2.62 48.77 Favored 'General case' 0 CA--C 1.552 1.055 0 C-N-CA 123.977 0.911 . . . . 0.0 113.346 179.406 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 568' ' ' LYS . . . . . . . . . . . . 0.326 20.1 ptpt 54.85 42.85 30.81 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 127.566 2.346 . . . . 0.0 113.434 -177.401 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 71.2 mm-40 -109.84 -177.27 3.22 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.624 0.77 . . . . 0.0 112.196 179.26 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 64.4 m -132.34 120.99 22.82 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 124.556 1.142 . . . . 0.0 110.977 178.218 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -81.74 149.77 4.73 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 C-N-CA 124.456 1.102 . . . . 0.0 110.258 168.056 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 3.4 t -149.0 155.62 41.06 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.969 0.907 . . . . 0.0 112.388 171.436 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -58.47 148.28 38.09 Favored Glycine 0 CA--C 1.534 1.251 0 C-N-CA 126.18 1.848 . . . . 0.0 116.661 -168.648 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 60.8 t -136.2 132.6 49.76 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 C-N-CA 125.691 1.596 . . . . 0.0 111.567 173.413 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 57.7 t80 -73.67 127.69 33.46 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 113.327 0.862 . . . . 0.0 113.327 -175.113 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 22.7 t0 -99.37 122.76 42.95 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 125.705 1.602 . . . . 0.0 110.45 169.237 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 64.7 mt-10 -73.55 -24.27 60.1 Favored 'General case' 0 CA--C 1.544 0.74 0 N-CA-C 113.793 1.035 . . . . 0.0 113.793 177.94 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -77.16 -52.48 9.2 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 119.401 1.001 . . . . 0.0 112.115 -176.234 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 89.9 p -74.42 -24.98 59.17 Favored 'General case' 0 N--CA 1.479 0.995 0 O-C-N 121.548 -0.72 . . . . 0.0 112.048 169.296 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 78.31 28.81 55.06 Favored Glycine 0 CA--C 1.536 1.403 0 C-N-CA 124.501 1.048 . . . . 0.0 113.15 -179.62 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -143.2 159.03 43.07 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.718 1.607 . . . . 0.0 112.645 -172.304 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 82.3 m95 -78.73 137.39 37.75 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.805 0.842 . . . . 0.0 111.677 176.946 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 19.2 m -130.0 151.28 35.62 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.762 0 C-N-CA 126.261 1.824 . . . . 0.0 112.912 -178.032 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 5.7 m0 -97.09 104.35 16.36 Favored 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 126.452 1.901 . . . . 0.0 110.553 169.321 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -70.87 148.39 47.85 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 124.221 1.009 . . . . 0.0 111.987 179.091 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 48.3 t30 50.45 45.48 26.34 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 124.855 1.262 . . . . 0.0 112.518 -179.785 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 94.2 m -130.93 145.84 52.15 Favored 'General case' 0 N--CA 1.48 1.052 0 N-CA-C 113.95 1.092 . . . . 0.0 113.95 -170.113 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 8.3 tt -143.33 151.72 16.89 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.62 0 C-N-CA 128.078 2.551 . . . . 0.0 110.477 -177.792 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 73.1 tt0 -119.03 126.8 52.55 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.338 1.455 . . . . 0.0 109.792 169.696 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 2.8 t -142.01 131.98 24.22 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 C-N-CA 126.78 2.032 . . . . 0.0 109.868 -175.795 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 16.5 m120 52.44 36.87 21.22 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 124.91 1.284 . . . . 0.0 113.931 178.981 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 78.67 8.93 87.47 Favored Glycine 0 CA--C 1.54 1.625 0 C-N-CA 124.796 1.189 . . . . 0.0 115.518 -179.752 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 53.0 mtmt -126.56 148.57 49.73 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 126.209 1.804 . . . . 0.0 111.431 -178.646 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 20.9 m-85 -89.58 149.12 22.99 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.167 0.987 . . . . 0.0 111.979 177.004 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 94.2 m-85 -151.34 162.85 40.18 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 125.783 1.633 . . . . 0.0 111.345 -179.995 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 596' ' ' HIS . . . . . 0.407 ' HB2' ' HB2' ' A' ' 599' ' ' CYS . 24.6 m80 -78.44 140.58 38.64 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 167.901 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 19.7 m -64.86 -39.52 93.68 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 118.36 0.527 . . . . 0.0 111.673 179.223 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 22.6 p -62.4 -46.08 90.24 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 123.721 0.808 . . . . 0.0 112.943 172.781 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 599' ' ' CYS . . . . . 0.407 ' HB2' ' HB2' ' A' ' 596' ' ' HIS . 94.0 m -60.04 -54.41 46.35 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 124.226 1.01 . . . . 0.0 111.312 177.883 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 89.7 t80 -62.32 -41.71 98.77 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.293 0.637 . . . . 0.0 112.126 -179.18 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 12.9 t-160 -61.29 -44.36 97.34 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.087 0.955 . . . . 0.0 112.388 176.348 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 25.8 tt0 -71.94 -34.39 68.98 Favored 'General case' 0 CA--C 1.545 0.788 0 N-CA-C 113.291 0.849 . . . . 0.0 113.291 178.612 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 92.1 m . . . . . 0 N--CA 1.478 0.926 0 N-CA-C 113.871 1.063 . . . . 0.0 113.871 -172.26 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 29.6 mm . . . . . 0 N--CA 1.479 1.014 0 CA-C-O 120.525 0.203 . . . . 0.0 111.333 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 19.8 ptp180 -75.43 -17.8 60.07 Favored 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 113.575 0.954 . . . . 0.0 113.575 -179.676 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -80.88 -9.57 86.13 Favored Glycine 0 CA--C 1.531 1.094 0 C-N-CA 124.77 1.176 . . . . 0.0 114.562 -179.38 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 69.3 mmtt -73.58 143.68 46.31 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 118.522 1.161 . . . . 0.0 112.221 179.581 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 40.6 p90 -159.69 167.21 28.9 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 125.292 1.437 . . . . 0.0 111.886 173.848 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 2.6 m -133.65 141.9 43.0 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.725 0 C-N-CA 125.928 1.691 . . . . 0.0 110.252 171.22 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 7.4 p -76.47 137.22 23.04 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.059 0 O-C-N 121.156 -0.965 . . . . 0.0 112.642 -170.241 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 72.5 t -75.64 125.68 88.23 Favored Pre-proline 0 N--CA 1.472 0.631 0 C-N-CA 124.475 1.11 . . . . 0.0 109.696 171.554 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_endo -78.34 142.67 19.05 Favored 'Trans proline' 0 CA--C 1.539 0.772 0 C-N-CA 122.994 2.463 . . . . 0.0 111.154 173.538 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -63.18 -17.38 62.33 Favored 'General case' 0 N--CA 1.48 1.037 0 O-C-N 121.016 -1.053 . . . . 0.0 113.063 172.36 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 11.3 m -64.93 -27.04 68.58 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 125.782 1.633 . . . . 0.0 112.71 171.481 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 29.2 t -70.6 125.86 27.99 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-N 119.12 0.873 . . . . 0.0 111.907 179.484 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 45.8 tt0 -74.99 -27.14 60.03 Favored 'General case' 0 CA--C 1.55 0.948 0 N-CA-C 112.953 0.723 . . . . 0.0 112.953 176.402 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 20.3 t0 -118.98 -11.37 9.69 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 114.328 1.233 . . . . 0.0 114.328 -172.363 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 79.8 mtp 56.98 34.85 25.58 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 125.976 1.71 . . . . 0.0 113.391 177.566 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -139.63 153.63 47.37 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 115.586 1.699 . . . . 0.0 115.586 -169.579 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 19.9 m-85 -148.18 174.3 12.12 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 128.449 2.699 . . . . 0.0 108.75 169.734 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 7.3 ttpm? -132.15 142.18 49.38 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 124.287 1.035 . . . . 0.0 113.114 -175.059 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 22.3 t -83.11 114.99 56.58 Favored Pre-proline 0 CA--C 1.546 0.819 0 C-N-CA 127.948 2.499 . . . . 0.0 111.03 172.778 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -63.5 -26.38 70.14 Favored 'Trans proline' 0 CA--C 1.538 0.705 0 C-N-CA 123.144 2.563 . . . . 0.0 114.985 173.927 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 89.8 mt -70.35 -55.44 14.51 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.885 0 C-N-CA 124.359 1.063 . . . . 0.0 111.552 -173.581 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 14.3 p -103.54 1.13 31.85 Favored 'General case' 0 CA--C 1.553 1.086 0 C-N-CA 124.79 1.236 . . . . 0.0 113.587 179.725 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 568' ' ' LYS . . . . . . . . . . . . . 29.6 mtpp 60.65 41.45 15.21 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 126.447 1.899 . . . . 0.0 112.448 -179.832 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 77.1 mt-10 -114.23 133.89 55.31 Favored 'General case' 0 N--CA 1.486 1.331 0 N-CA-C 114.208 1.188 . . . . 0.0 114.208 -174.033 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 89.3 m -83.58 118.43 23.8 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 124.051 0.94 . . . . 0.0 111.289 177.573 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 3.5 m -81.95 149.09 4.91 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 124.566 1.146 . . . . 0.0 110.715 168.805 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 82.3 p -133.08 156.36 47.54 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 125.504 1.522 . . . . 0.0 111.273 177.008 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -65.58 140.82 41.39 Favored Glycine 0 CA--C 1.532 1.109 0 N-CA-C 115.043 0.777 . . . . 0.0 115.043 -178.763 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 85.6 t -134.49 131.47 54.39 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 C-N-CA 125.236 1.414 . . . . 0.0 110.492 178.489 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 74.6 t80 -73.89 123.9 25.13 Favored 'General case' 0 CA--C 1.543 0.673 0 N-CA-C 113.573 0.953 . . . . 0.0 113.573 -173.731 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 54.0 t0 -92.64 114.93 27.62 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.214 1.406 . . . . 0.0 109.559 169.233 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -71.32 -27.07 63.13 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 114.062 1.134 . . . . 0.0 114.062 -175.648 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 50.1 mm-40 -88.18 -39.26 14.64 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 124.282 1.033 . . . . 0.0 112.034 -179.591 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 32.4 t -70.84 -35.01 72.24 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 122.964 0.506 . . . . 0.0 112.058 169.99 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 81.35 25.57 54.19 Favored Glycine 0 CA--C 1.534 1.222 0 C-N-CA 125.058 1.313 . . . . 0.0 112.921 -176.482 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 78.8 mm-40 -141.57 152.65 44.25 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.89 1.276 . . . . 0.0 111.876 -170.461 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 84.2 m95 -77.06 138.68 39.7 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 123.862 0.865 . . . . 0.0 110.757 171.584 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 23.4 m -135.24 148.72 28.63 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 C-N-CA 125.415 1.486 . . . . 0.0 113.31 -175.63 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 4.1 m0 -87.63 99.62 12.2 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 126.534 1.934 . . . . 0.0 109.169 169.694 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 32.6 mmtp -68.72 148.44 50.37 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 124.093 0.957 . . . . 0.0 111.881 -178.245 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 64.2 t30 53.63 33.43 16.47 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 125.763 1.625 . . . . 0.0 113.144 179.221 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 90.1 m -116.87 142.83 46.43 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 124.05 0.94 . . . . 0.0 112.645 -171.736 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 11.1 tt -134.94 144.91 33.29 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 C-N-CA 127.71 2.404 . . . . 0.0 110.116 -179.638 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 73.6 tt0 -112.18 136.99 50.89 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 124.683 1.193 . . . . 0.0 110.713 171.272 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 12.7 p -148.56 136.12 13.97 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 C-N-CA 124.421 1.088 . . . . 0.0 110.925 172.268 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 66.0 t30 51.22 37.21 17.87 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 125.038 1.335 . . . . 0.0 113.537 177.761 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 78.1 8.3 87.44 Favored Glycine 0 CA--C 1.537 1.424 0 C-N-CA 124.829 1.204 . . . . 0.0 116.086 -179.279 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -122.94 149.61 44.04 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 125.92 1.688 . . . . 0.0 111.879 -178.147 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 72.6 m-85 -98.69 147.12 25.17 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.633 1.173 . . . . 0.0 113.176 -179.665 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 98.6 m-85 -150.85 168.89 23.1 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 126.551 1.94 . . . . 0.0 110.706 179.664 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 596' ' ' HIS . . . . . . . . . . . . . 22.8 m80 -86.17 144.17 27.62 Favored 'General case' 0 N--CA 1.471 0.605 0 O-C-N 121.288 -0.882 . . . . 0.0 110.08 168.057 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 15.6 m -65.35 -43.54 90.55 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 123.42 0.688 . . . . 0.0 111.969 179.888 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 22.2 p -64.64 -37.69 88.44 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 124.013 0.925 . . . . 0.0 112.966 174.29 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 599' ' ' CYS . . . . . . . . . . . . . 89.6 m -65.86 -59.76 3.54 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.135 0.974 . . . . 0.0 110.965 176.211 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 75.8 t80 -59.13 -38.39 79.52 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.169 0.988 . . . . 0.0 113.481 -175.245 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 76.6 t60 -56.69 -58.3 8.69 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 114.712 1.375 . . . . 0.0 114.712 -173.198 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 15.2 tt0 -98.14 -10.87 23.5 Favored 'General case' 0 CA--C 1.545 0.767 0 N-CA-C 113.637 0.977 . . . . 0.0 113.637 -174.387 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 98.6 m . . . . . 0 N--CA 1.485 1.276 0 O-C-N 121.157 -0.964 . . . . 0.0 112.242 179.42 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 16.7 mm . . . . . 0 CA--C 1.539 0.554 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 7.3 tmm_? -66.37 -36.35 82.65 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 124.111 0.964 . . . . 0.0 111.39 178.919 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -67.15 -6.4 39.02 Favored Glycine 0 CA--C 1.535 1.307 0 C-N-CA 125.704 1.621 . . . . 0.0 116.561 175.801 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt -70.95 134.37 47.14 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-N 119.754 1.777 . . . . 0.0 110.991 171.494 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 41.6 p90 -148.49 166.74 27.29 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 114.443 1.275 . . . . 0.0 114.443 179.697 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -136.91 138.99 45.4 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 C-N-CA 126.776 2.03 . . . . 0.0 109.241 173.722 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 83.8 t -70.48 132.02 33.67 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.994 0 O-C-N 121.043 -1.036 . . . . 0.0 110.908 -174.701 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 87.3 t -71.72 124.87 91.55 Favored Pre-proline 0 CA--C 1.541 0.629 0 C-N-CA 125.331 1.453 . . . . 0.0 109.963 175.268 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 95.5 Cg_endo -78.87 152.21 24.92 Favored 'Trans proline' 0 C--N 1.349 0.567 0 C-N-CA 123.036 2.49 . . . . 0.0 112.19 177.293 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 56.1 mt-10 -62.54 -21.67 65.74 Favored 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 113.215 0.82 . . . . 0.0 113.215 174.001 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 67.8 p -78.61 -11.85 59.99 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 125.89 1.676 . . . . 0.0 113.882 176.104 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 88.5 p -63.7 144.26 57.17 Favored 'General case' 0 N--CA 1.48 1.032 0 CA-C-N 119.242 0.928 . . . . 0.0 112.756 178.062 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 64.5 mt-30 -83.12 118.62 23.7 Favored 'General case' 0 N--CA 1.467 0.404 0 O-C-N 121.449 -0.782 . . . . 0.0 109.287 169.657 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 38.0 m-20 52.15 24.31 2.7 Favored 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 126.415 1.886 . . . . 0.0 115.197 177.47 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 8.9 mtt 54.75 36.21 25.81 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.97 1.308 . . . . 0.0 113.65 -176.453 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -125.03 147.09 49.13 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 114.368 1.247 . . . . 0.0 114.368 -171.491 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 6.5 t80 -155.48 166.4 33.66 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 125.611 1.564 . . . . 0.0 111.084 172.193 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 39.5 ttmt -107.61 148.7 28.97 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 124.907 1.283 . . . . 0.0 114.352 -171.129 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 33.9 t -95.15 110.45 50.28 Favored Pre-proline 0 CA--C 1.543 0.709 0 C-N-CA 128.384 2.674 . . . . 0.0 110.033 167.905 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -64.66 -21.7 65.05 Favored 'Trans proline' 0 CA--C 1.538 0.701 0 C-N-CA 123.037 2.491 . . . . 0.0 115.425 177.649 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 85.0 mt -70.95 -55.46 13.99 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.928 0 C-N-CA 124.025 0.93 . . . . 0.0 110.873 -177.436 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 14.7 p -103.38 0.1 30.83 Favored 'General case' 0 CA--C 1.552 1.052 0 N-CA-C 113.909 1.078 . . . . 0.0 113.909 -178.251 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 568' ' ' LYS . . . . . . . . . . . . 0.332 25.0 pttm 55.32 46.1 24.18 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 127.775 2.43 . . . . 0.0 113.419 -175.481 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 69.6 mm-40 -121.16 150.15 41.72 Favored 'General case' 0 N--CA 1.483 1.176 0 N-CA-C 113.715 1.006 . . . . 0.0 113.715 -175.583 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 89.1 m -93.46 120.79 34.16 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 124.108 0.963 . . . . 0.0 112.303 -176.111 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 2.6 m -79.14 147.16 6.94 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.671 0 C-N-CA 124.215 1.006 . . . . 0.0 110.084 167.326 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 68.6 p -127.53 148.05 50.33 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 124.52 1.128 . . . . 0.0 111.386 175.547 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -70.75 147.39 43.34 Favored Glycine 0 CA--C 1.534 1.26 0 C-N-CA 123.887 0.756 . . . . 0.0 114.001 -178.55 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 85.9 t -133.62 136.37 54.42 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 C-N-CA 125.362 1.465 . . . . 0.0 111.185 177.235 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 63.8 t80 -72.99 118.87 16.47 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 123.478 0.711 . . . . 0.0 112.78 -176.622 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 63.4 t0 -82.68 110.52 17.81 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 168.436 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 57.9 mt-10 -68.12 -25.86 65.51 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 124.692 1.197 . . . . 0.0 113.946 -175.445 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 38.0 tp10 -80.51 -48.44 12.78 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 123.255 0.622 . . . . 0.0 112.229 -176.371 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 99.1 p -78.82 -28.72 44.48 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 123.52 0.728 . . . . 0.0 112.473 173.416 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 82.15 31.13 32.34 Favored Glycine 0 CA--C 1.538 1.474 0 C-N-CA 124.853 1.216 . . . . 0.0 112.606 -177.049 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 56.2 mt-10 -135.34 145.59 47.57 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 118.636 1.218 . . . . 0.0 111.311 -173.963 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 69.9 m95 -77.54 141.02 39.82 Favored 'General case' 0 N--CA 1.466 0.342 0 O-C-N 121.273 -0.892 . . . . 0.0 111.523 177.235 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 17.3 m -135.91 142.59 38.6 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 C-N-CA 125.853 1.661 . . . . 0.0 112.757 -172.93 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 2.0 m0 -88.97 95.36 10.29 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 125.175 1.39 . . . . 0.0 108.019 170.168 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -69.5 160.94 30.51 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 124.291 1.036 . . . . 0.0 111.396 175.007 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 54.61 32.05 16.31 Favored 'General case' 0 CA--C 1.553 1.074 0 C-N-CA 125.04 1.336 . . . . 0.0 112.607 -177.92 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 73.0 m -125.15 146.73 49.36 Favored 'General case' 0 N--CA 1.479 0.984 0 O-C-N 120.978 -1.077 . . . . 0.0 113.564 -169.492 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 18.1 tt -143.19 149.29 18.55 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 C-N-CA 127.085 2.154 . . . . 0.0 110.85 177.924 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 72.6 tt0 -107.89 122.27 46.45 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 124.482 1.113 . . . . 0.0 110.002 168.744 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 2.0 t -144.16 142.11 24.29 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.866 0 C-N-CA 126.332 1.853 . . . . 0.0 109.682 -174.559 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 23.8 t-20 52.27 26.64 4.14 Favored 'General case' 0 CA--C 1.554 1.128 0 C-N-CA 125.526 1.531 . . . . 0.0 114.189 177.537 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 88.42 1.79 80.6 Favored Glycine 0 CA--C 1.54 1.646 0 C-N-CA 125.721 1.629 . . . . 0.0 116.455 -177.786 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 2.7 mptt -128.43 161.18 30.08 Favored 'General case' 0 N--CA 1.479 1.01 0 CA-C-N 119.42 1.61 . . . . 0.0 113.285 -177.823 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 3.6 m-85 -81.78 148.9 28.65 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 115.541 -0.754 . . . . 0.0 111.59 171.746 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 64.2 m-85 -152.87 161.79 42.11 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 126.334 1.853 . . . . 0.0 110.854 -178.106 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 596' ' ' HIS . . . . . 0.413 ' HB2' ' HB2' ' A' ' 599' ' ' CYS . 21.1 m80 -76.97 136.14 38.73 Favored 'General case' 0 N--CA 1.473 0.698 0 N-CA-C 108.259 -1.015 . . . . 0.0 108.259 167.222 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 47.8 p -59.39 -37.45 77.99 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 123.532 0.733 . . . . 0.0 112.375 178.114 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 5.7 p -70.31 -50.51 38.48 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.723 1.209 . . . . 0.0 112.637 175.171 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 599' ' ' CYS . . . . . 0.413 ' HB2' ' HB2' ' A' ' 596' ' ' HIS . 91.4 m -51.51 -52.26 48.34 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.278 1.031 . . . . 0.0 111.423 175.007 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 53.6 t80 -58.51 -52.21 66.61 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 123.483 0.713 . . . . 0.0 111.734 176.605 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 51.6 t-80 -61.81 -38.53 88.48 Favored 'General case' 0 N--CA 1.475 0.824 0 N-CA-C 113.372 0.878 . . . . 0.0 113.372 -176.489 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -71.07 -18.9 62.53 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 113.736 1.014 . . . . 0.0 113.736 175.567 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 88.7 m . . . . . 0 N--CA 1.476 0.83 0 C-N-CA 124.624 1.17 . . . . 0.0 112.132 -177.733 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 31.1 mm . . . . . 0 N--CA 1.473 0.687 0 N-CA-C 112.712 0.634 . . . . 0.0 112.712 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 9.4 ptp180 -70.08 -10.86 60.11 Favored 'General case' 0 N--CA 1.478 0.971 0 N-CA-C 115.756 1.761 . . . . 0.0 115.756 -170.999 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -77.42 -14.56 82.37 Favored Glycine 0 CA--C 1.539 1.542 0 C-N-CA 123.905 0.765 . . . . 0.0 114.838 178.04 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -71.59 147.05 47.99 Favored 'General case' 0 N--CA 1.477 0.911 0 CA-C-N 118.831 1.316 . . . . 0.0 113.472 -177.118 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 51.6 p90 -154.84 162.48 41.09 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 125.603 1.561 . . . . 0.0 111.698 169.554 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -134.74 137.57 50.79 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 C-N-CA 125.899 1.68 . . . . 0.0 110.295 177.709 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 40.7 t -68.29 132.02 33.06 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 C-N-CA 123.671 0.788 . . . . 0.0 109.951 -179.122 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 21.2 t -73.66 123.69 89.61 Favored Pre-proline 0 N--CA 1.474 0.745 0 C-N-CA 124.144 0.978 . . . . 0.0 109.131 171.075 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_endo -70.59 146.32 54.76 Favored 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 122.5 2.133 . . . . 0.0 111.699 178.045 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -62.98 -18.77 63.64 Favored 'General case' 0 N--CA 1.474 0.75 0 O-C-N 121.367 -0.833 . . . . 0.0 113.157 174.184 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 18.7 m -58.53 -32.76 69.16 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 124.943 1.297 . . . . 0.0 111.726 169.296 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 19.7 t -81.73 101.57 10.19 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.623 0.769 . . . . 0.0 111.372 172.079 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 93.0 mt-30 -71.86 -30.66 65.67 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 123.289 0.636 . . . . 0.0 112.242 175.071 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 76.5 m-20 -91.12 -19.7 22.83 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.152 0.981 . . . . 0.0 113.456 -177.348 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 6.2 mtt 55.76 33.08 20.72 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 125.815 1.646 . . . . 0.0 114.95 178.779 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -133.25 136.61 45.66 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.027 0.931 . . . . 0.0 113.24 -175.317 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -143.61 161.1 39.38 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 126.329 1.852 . . . . 0.0 110.753 175.53 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 23.7 tptt -94.75 157.85 15.77 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 124.442 1.097 . . . . 0.0 113.626 -173.957 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 15.2 t -109.98 96.45 25.08 Favored Pre-proline 0 CA--C 1.547 0.838 0 C-N-CA 126.755 2.022 . . . . 0.0 107.566 165.659 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -60.06 -17.61 46.1 Favored 'Trans proline' 0 CA--C 1.548 1.183 0 C-N-CA 122.586 2.191 . . . . 0.0 115.342 177.325 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 73.0 mt -72.58 -58.25 5.41 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.892 0 C-N-CA 124.81 1.244 . . . . 0.0 111.076 -179.942 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 13.7 p -101.93 1.64 37.04 Favored 'General case' 0 CA--C 1.553 1.074 0 N-CA-C 113.964 1.098 . . . . 0.0 113.964 -179.24 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 568' ' ' LYS . . . . . . . . . . . . . 53.6 mtmt 62.37 36.38 14.45 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 128.125 2.57 . . . . 0.0 113.322 -179.033 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 51.2 mm-40 -100.71 173.03 6.72 Favored 'General case' 0 N--CA 1.481 1.124 0 O-C-N 121.731 -0.606 . . . . 0.0 112.539 -177.796 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 59.2 m -118.26 120.97 39.25 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 124.542 1.137 . . . . 0.0 110.71 172.81 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 1.5 m -83.28 121.51 36.26 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.726 0 C-N-CA 124.837 1.255 . . . . 0.0 109.667 169.169 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 47.6 p -106.17 141.72 37.06 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 124.822 1.249 . . . . 0.0 111.263 175.002 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -65.91 148.27 50.88 Favored Glycine 0 CA--C 1.528 0.873 0 C-N-CA 124.099 0.857 . . . . 0.0 113.438 179.241 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 65.0 t -131.21 129.01 62.49 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 C-N-CA 125.743 1.617 . . . . 0.0 111.25 179.909 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 35.1 t80 -74.74 124.38 26.66 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 113.004 0.742 . . . . 0.0 113.004 -175.144 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 64.0 t0 -90.61 106.37 18.46 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.92 1.288 . . . . 0.0 109.156 168.609 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 57.7 mt-10 -66.54 -26.38 67.11 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.051 0.94 . . . . 0.0 113.427 -178.324 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -81.82 -44.72 16.55 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 124.38 1.072 . . . . 0.0 111.798 -178.642 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 53.9 m -77.37 -26.88 52.33 Favored 'General case' 0 N--CA 1.476 0.859 0 N-CA-C 112.946 0.721 . . . . 0.0 112.946 174.318 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 76.99 29.05 57.66 Favored Glycine 0 CA--C 1.539 1.561 0 C-N-CA 125.052 1.311 . . . . 0.0 113.52 -176.445 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 77.4 mm-40 -139.24 150.91 46.05 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 125.839 1.656 . . . . 0.0 111.164 -173.256 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 67.7 m95 -84.73 146.07 27.6 Favored 'General case' 0 N--CA 1.468 0.427 0 O-C-N 121.396 -0.815 . . . . 0.0 110.852 173.468 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 27.9 m -133.49 151.75 33.98 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.977 0 C-N-CA 125.838 1.655 . . . . 0.0 113.678 -178.382 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 3.3 m0 -105.22 107.89 19.12 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 127.241 2.217 . . . . 0.0 107.128 171.606 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -86.24 149.62 24.95 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 125.013 1.325 . . . . 0.0 112.594 -174.791 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 65.0 t30 50.8 32.57 7.31 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 126.106 1.762 . . . . 0.0 113.008 -169.576 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 98.0 m -113.81 146.57 39.76 Favored 'General case' 0 N--CA 1.476 0.833 0 O-C-N 120.92 -1.113 . . . . 0.0 111.993 -172.685 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 9.3 tt -127.55 137.52 57.44 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 C-N-CA 126.779 2.031 . . . . 0.0 110.783 175.101 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -94.98 130.86 41.46 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 125.302 1.441 . . . . 0.0 110.185 169.484 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 12.7 p -150.84 132.42 5.15 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 C-N-CA 124.813 1.245 . . . . 0.0 111.254 174.472 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 77.3 m-20 52.04 40.06 27.65 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 124.935 1.294 . . . . 0.0 114.484 174.504 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 77.4 10.24 86.36 Favored Glycine 0 CA--C 1.541 1.674 0 C-N-CA 125.39 1.472 . . . . 0.0 115.257 -178.866 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 48.6 mttp -133.2 171.65 13.73 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 126.885 2.074 . . . . 0.0 111.03 -170.837 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 84.6 m-85 -121.98 153.09 39.0 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 124.373 1.069 . . . . 0.0 113.673 -176.986 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 23.8 m-85 -151.87 164.82 36.29 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 126.986 2.115 . . . . 0.0 109.941 175.921 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 596' ' ' HIS . . . . . . . . . . . . . 25.5 m80 -77.76 138.67 39.14 Favored 'General case' 0 N--CA 1.468 0.46 0 N-CA-C 107.407 -1.331 . . . . 0.0 107.407 165.906 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 5.5 t -64.36 -39.07 93.14 Favored 'General case' 0 CA--C 1.539 0.539 0 O-C-N 121.597 -0.69 . . . . 0.0 111.952 -177.454 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 18.3 p -66.3 -37.28 85.05 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 124.735 1.214 . . . . 0.0 113.61 173.354 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 599' ' ' CYS . . . . . . . . . . . . . 72.3 m -63.88 -54.83 28.67 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 123.797 0.839 . . . . 0.0 110.644 173.337 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 75.9 t80 -57.97 -37.51 74.32 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 125.046 1.339 . . . . 0.0 112.665 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 11.8 t-160 -60.59 -35.52 76.3 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.231 1.012 . . . . 0.0 113.19 176.254 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -79.67 -33.35 41.28 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 113.65 0.982 . . . . 0.0 113.65 176.328 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 69.8 p . . . . . 0 N--CA 1.48 1.032 0 N-CA-C 114.645 1.35 . . . . 0.0 114.645 -174.922 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 14.6 mm . . . . . 0 N--CA 1.476 0.873 0 CA-C-O 120.632 0.253 . . . . 0.0 111.232 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 39.3 mmt180 -58.19 -25.5 61.64 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 124.24 1.016 . . . . 0.0 112.799 171.856 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -79.88 -7.62 88.36 Favored Glycine 0 CA--C 1.536 1.394 0 C-N-CA 125.966 1.746 . . . . 0.0 115.013 -179.983 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 8.9 mmpt? -66.7 147.02 53.83 Favored 'General case' 0 N--CA 1.482 1.131 0 CA-C-N 119.811 1.805 . . . . 0.0 111.091 171.793 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 52.5 p90 -151.51 162.46 40.92 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.549 0.739 . . . . 0.0 112.787 171.193 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 1.6 m -130.44 134.69 61.94 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.926 0 C-N-CA 125.853 1.661 . . . . 0.0 109.74 173.075 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 10.0 p -67.8 138.01 23.5 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 O-C-N 121.616 -0.678 . . . . 0.0 111.731 -175.75 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 57.6 t -87.94 112.09 46.87 Favored Pre-proline 0 CA--C 1.544 0.744 0 C-N-CA 125.459 1.504 . . . . 0.0 108.941 170.19 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 67.5 Cg_endo -76.66 156.33 35.67 Favored 'Trans proline' 0 C--N 1.348 0.525 0 C-N-CA 122.62 2.213 . . . . 0.0 111.664 176.045 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 46.7 tt0 -58.02 -33.49 69.01 Favored 'General case' 0 CA--C 1.54 0.59 0 O-C-N 121.331 -0.856 . . . . 0.0 112.282 174.125 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 15.2 m -59.04 -25.98 64.18 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 125.463 1.505 . . . . 0.0 113.719 175.299 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 10.0 t -69.12 -23.61 64.0 Favored 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 113.092 0.775 . . . . 0.0 113.092 177.229 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 30.5 mt-30 59.35 -62.37 0.05 OUTLIER 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 129.211 3.005 . . . . 0.0 115.915 176.251 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 65.9 m-20 -82.21 -14.14 56.03 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 125.733 1.613 . . . . 0.0 113.374 -175.804 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 11.1 mtt 56.96 25.68 10.91 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 126.398 1.879 . . . . 0.0 114.976 179.582 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -131.42 144.75 51.42 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.265 1.026 . . . . 0.0 113.265 -171.748 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 4.5 t80 -153.84 -178.45 7.06 Favored 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 125.899 1.68 . . . . 0.0 109.668 173.131 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 5.2 tmmm? -137.05 134.17 36.25 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 125.027 1.331 . . . . 0.0 112.635 -178.695 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 30.9 t -69.55 117.17 50.4 Favored Pre-proline 0 CA--C 1.543 0.707 0 C-N-CA 126.681 1.993 . . . . 0.0 111.007 174.086 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_exo -65.11 -26.59 57.56 Favored 'Trans proline' 0 CA--C 1.542 0.885 0 C-N-CA 123.047 2.498 . . . . 0.0 114.646 175.739 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 80.6 mt -71.52 -57.46 7.44 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 C-N-CA 124.622 1.169 . . . . 0.0 111.418 -173.325 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 16.9 p -98.54 -1.86 40.1 Favored 'General case' 0 CA--C 1.549 0.932 0 N-CA-C 113.61 0.967 . . . . 0.0 113.61 179.276 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 568' ' ' LYS . . . . . . . . . . . . . 95.7 mttt 60.35 46.7 9.73 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 126.621 1.968 . . . . 0.0 112.778 -177.781 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 73.2 mm-40 -125.85 139.08 53.78 Favored 'General case' 0 N--CA 1.483 1.176 0 N-CA-C 115.481 1.66 . . . . 0.0 115.481 -174.24 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 24.4 m -69.66 138.51 53.07 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.734 1.214 . . . . 0.0 113.127 -179.109 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -112.73 140.07 34.5 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 C-N-CA 126.639 1.976 . . . . 0.0 109.904 167.841 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 44.4 p -130.42 144.03 51.14 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 125.377 1.471 . . . . 0.0 110.961 178.452 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -65.95 144.27 46.3 Favored Glycine 0 CA--C 1.53 1.006 0 C-N-CA 123.773 0.701 . . . . 0.0 114.093 -179.118 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 19.2 m -128.92 149.22 33.43 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 C-N-CA 125.68 1.592 . . . . 0.0 111.742 174.914 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 62.8 t80 -74.25 140.42 44.99 Favored 'General case' 0 CA--C 1.542 0.663 0 O-C-N 121.311 -0.868 . . . . 0.0 113.08 -175.94 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 21.1 t0 -115.81 118.53 33.28 Favored 'General case' 0 C--O 1.236 0.342 0 C-N-CA 126.776 2.031 . . . . 0.0 110.82 171.186 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 23.6 mp0 -74.27 -25.97 59.92 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 124.183 0.993 . . . . 0.0 113.383 -177.389 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 37.2 tp10 -74.48 -49.13 23.44 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 124.421 1.088 . . . . 0.0 112.195 -179.459 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 20.5 m -77.18 -31.71 55.6 Favored 'General case' 0 N--CA 1.476 0.833 0 O-C-N 121.739 -0.601 . . . . 0.0 111.924 172.637 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 76.38 30.48 56.7 Favored Glycine 0 CA--C 1.535 1.309 0 C-N-CA 123.506 0.574 . . . . 0.0 111.878 -170.11 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 79.9 mm-40 -130.95 175.92 8.67 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 126.253 1.821 . . . . 0.0 111.085 -174.166 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 62.4 m95 -100.15 149.77 23.19 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 123.969 0.908 . . . . 0.0 111.026 172.306 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 13.0 m -140.84 147.05 23.14 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 C-N-CA 125.94 1.696 . . . . 0.0 112.871 -172.311 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 4.1 m0 -97.64 106.64 18.99 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 125.905 1.682 . . . . 0.0 107.891 169.057 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 42.8 mtmt -81.96 153.22 26.37 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 124.133 0.973 . . . . 0.0 112.282 -179.456 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 54.25 33.65 18.66 Favored 'General case' 0 CA--C 1.554 1.101 0 C-N-CA 125.646 1.578 . . . . 0.0 111.601 -174.825 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 65.5 m -130.03 150.86 51.12 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 125.307 1.443 . . . . 0.0 112.293 -169.407 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 9.9 tt -140.24 146.32 24.82 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.653 0 C-N-CA 128.508 2.723 . . . . 0.0 110.108 -179.667 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 67.3 tt0 -113.77 132.87 55.69 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 125.35 1.46 . . . . 0.0 110.689 170.272 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 9.4 p -157.19 143.71 9.71 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 C-N-CA 124.479 1.112 . . . . 0.0 111.411 176.378 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 9.4 t-20 52.78 32.9 13.0 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 125.285 1.434 . . . . 0.0 114.421 178.223 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 76.05 9.76 85.33 Favored Glycine 0 CA--C 1.538 1.489 0 C-N-CA 124.698 1.142 . . . . 0.0 115.563 -177.511 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 99.6 mttt -122.13 152.45 39.88 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 126.013 1.725 . . . . 0.0 111.493 -179.983 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 79.0 m-85 -98.65 150.62 21.57 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 124.084 0.954 . . . . 0.0 112.751 170.304 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 93.4 m-85 -151.44 161.51 42.56 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 125.959 1.704 . . . . 0.0 110.1 -179.681 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 596' ' ' HIS . . . . . 0.437 ' HB2' ' HB2' ' A' ' 599' ' ' CYS . 28.6 m80 -75.71 141.89 42.58 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 167.027 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 50.3 p -61.26 -42.71 99.1 Favored 'General case' 0 N--CA 1.47 0.525 0 C-N-CA 123.592 0.757 . . . . 0.0 112.214 -179.321 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 2.7 p -68.35 -42.0 79.85 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 124.42 1.088 . . . . 0.0 112.791 175.457 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 599' ' ' CYS . . . . . 0.437 ' HB2' ' HB2' ' A' ' 596' ' ' HIS . 69.4 m -58.68 -59.2 5.79 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.192 0.997 . . . . 0.0 110.894 175.068 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 79.2 t80 -57.76 -43.25 85.35 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.375 1.07 . . . . 0.0 112.648 -177.912 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 82.5 t60 -58.13 -39.49 78.85 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 179.855 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 37.9 tp10 -90.45 -25.26 20.43 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 114.241 1.2 . . . . 0.0 114.241 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 28.3 m . . . . . 0 N--CA 1.482 1.164 0 N-CA-C 115.766 1.765 . . . . 0.0 115.766 -166.924 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 22.7 mm . . . . . 0 N--CA 1.476 0.829 0 CA-C-O 120.509 0.195 . . . . 0.0 111.45 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 30.7 mmm-85 -64.59 -29.93 70.95 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.739 1.216 . . . . 0.0 112.693 178.564 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -82.54 -7.29 87.7 Favored Glycine 0 CA--C 1.535 1.282 0 C-N-CA 125.056 1.312 . . . . 0.0 115.133 179.9 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -69.99 145.85 51.51 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 118.904 1.352 . . . . 0.0 111.829 176.806 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 38.6 p90 -153.39 166.92 31.15 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 125.032 1.333 . . . . 0.0 112.773 175.296 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 2.4 m -131.1 138.72 52.75 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.5 0 C-N-CA 125.733 1.613 . . . . 0.0 110.136 169.774 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 9.9 p -69.36 136.41 26.32 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 O-C-N 121.319 -0.863 . . . . 0.0 111.623 -176.993 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 51.1 t -76.31 123.89 88.0 Favored Pre-proline 0 CA--C 1.543 0.706 0 C-N-CA 124.805 1.242 . . . . 0.0 109.586 177.352 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -74.9 150.2 38.33 Favored 'Trans proline' 0 CA--C 1.543 0.939 0 C-N-CA 122.993 2.462 . . . . 0.0 111.028 175.998 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 50.3 mt-10 -65.09 -19.29 65.92 Favored 'General case' 0 CA--C 1.549 0.926 0 N-CA-C 113.479 0.918 . . . . 0.0 113.479 177.723 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 68.2 p -68.71 -24.92 64.54 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 124.216 1.006 . . . . 0.0 113.153 170.334 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 17.5 t -79.36 76.55 5.93 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-O 122.371 1.081 . . . . 0.0 110.299 169.791 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 62.6 tt0 -60.33 -34.45 73.84 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.356 1.062 . . . . 0.0 112.956 -174.496 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 69.4 m-20 -87.51 -6.59 58.3 Favored 'General case' 0 CA--C 1.551 0.981 0 C-N-CA 124.954 1.302 . . . . 0.0 113.74 175.114 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 9.0 mtt 52.24 38.44 24.66 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 126.785 2.034 . . . . 0.0 114.188 -178.116 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -128.26 143.43 51.03 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 114.244 1.201 . . . . 0.0 114.244 -173.168 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -143.36 176.54 9.08 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 126.487 1.915 . . . . 0.0 109.322 172.826 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 563' ' ' LYS . . . . . . . . . . . . 0.255 0.0 OUTLIER -141.76 148.16 38.52 Favored 'General case' 0 N--CA 1.477 0.888 0 N-CA-C 114.767 1.395 . . . . 0.0 114.767 175.891 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 12.0 t -79.32 116.85 63.49 Favored Pre-proline 0 CA--C 1.542 0.636 0 C-N-CA 126.765 2.026 . . . . 0.0 111.006 173.451 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_endo -72.51 -18.15 26.12 Favored 'Trans proline' 0 CA--C 1.545 1.073 0 C-N-CA 122.719 2.279 . . . . 0.0 113.612 174.782 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 90.7 mt -71.49 -55.22 14.47 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.9 0 C-N-CA 124.514 1.125 . . . . 0.0 110.747 -178.442 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 13.9 p -103.61 2.52 33.42 Favored 'General case' 0 CA--C 1.552 1.028 0 N-CA-C 114.137 1.162 . . . . 0.0 114.137 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 568' ' ' LYS . . . . . . . . . . . . 0.308 11.9 ptmm? 54.52 46.61 24.52 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 127.04 2.136 . . . . 0.0 113.82 -177.045 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 69.2 mm-40 -124.81 143.33 50.87 Favored 'General case' 0 N--CA 1.482 1.143 0 N-CA-C 114.835 1.42 . . . . 0.0 114.835 -176.108 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 73.9 m -78.06 145.66 35.72 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 124.241 1.017 . . . . 0.0 112.749 -178.589 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -119.61 131.7 71.43 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.892 0 C-N-CA 127.014 2.126 . . . . 0.0 109.752 168.305 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 38.9 p -111.86 147.02 36.67 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 125.064 1.345 . . . . 0.0 111.753 178.277 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -71.02 147.57 43.16 Favored Glycine 0 CA--C 1.532 1.101 0 C-N-CA 124.933 1.254 . . . . 0.0 113.743 178.621 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 60.9 t -139.47 132.49 36.93 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 C-N-CA 124.56 1.144 . . . . 0.0 111.083 -176.465 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 68.5 t80 -70.12 112.1 6.24 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 118.706 0.684 . . . . 0.0 111.522 179.478 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 23.2 t0 -81.8 112.02 18.57 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 123.331 0.653 . . . . 0.0 109.559 169.39 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 53.6 mt-10 -69.43 -19.31 63.79 Favored 'General case' 0 CA--C 1.546 0.812 0 N-CA-C 113.913 1.079 . . . . 0.0 113.913 178.836 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 33.2 tp10 -77.38 -51.41 10.86 Favored 'General case' 0 CA--C 1.543 0.71 0 O-C-N 121.366 -0.834 . . . . 0.0 112.811 178.898 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 32.2 t -76.06 -33.42 59.58 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 124.309 1.044 . . . . 0.0 112.686 172.318 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 86.09 31.18 20.84 Favored Glycine 0 CA--C 1.531 1.064 0 C-N-CA 125.038 1.304 . . . . 0.0 113.63 -176.761 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 74.1 mm-40 -142.31 151.66 42.19 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 125.504 1.522 . . . . 0.0 111.825 -172.459 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 82.5 m95 -75.84 134.4 40.36 Favored 'General case' 0 N--CA 1.468 0.437 0 O-C-N 121.653 -0.654 . . . . 0.0 111.7 172.521 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 17.0 m -135.05 143.0 38.5 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.559 0 C-N-CA 125.414 1.486 . . . . 0.0 113.327 -171.844 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 3.7 m0 -91.03 100.95 13.72 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 126.287 1.835 . . . . 0.0 107.857 169.288 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -73.98 153.85 39.56 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 124.169 0.988 . . . . 0.0 111.66 -179.68 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 54.63 36.75 26.76 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 125.03 1.332 . . . . 0.0 112.047 179.409 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 85.0 m -129.83 148.19 51.68 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 125.173 1.389 . . . . 0.0 112.113 -170.328 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 588' ' ' ILE . . . . . 0.406 HG23 ' HB2' ' A' ' 595' ' ' PHE . 15.4 tt -145.84 146.3 19.46 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 C-N-CA 126.912 2.085 . . . . 0.0 111.503 -178.388 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 8.9 tm-20 -107.54 145.6 32.94 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.852 1.261 . . . . 0.0 111.172 166.343 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 1.2 t -159.32 144.58 6.56 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 C-N-CA 126.196 1.798 . . . . 0.0 109.765 171.589 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 10.6 t-20 54.99 29.87 13.09 Favored 'General case' 0 CA--C 1.554 1.133 0 N-CA-C 114.17 1.174 . . . . 0.0 114.17 175.036 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 76.73 14.06 82.91 Favored Glycine 0 CA--C 1.535 1.284 0 C-N-CA 124.618 1.104 . . . . 0.0 115.066 -176.45 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 51.1 mttp -131.31 146.83 52.46 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 126.088 1.755 . . . . 0.0 110.873 -171.337 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 57.4 m-85 -102.35 147.85 26.2 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 123.857 0.863 . . . . 0.0 112.838 -178.329 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 595' ' ' PHE . . . . . 0.406 ' HB2' HG23 ' A' ' 588' ' ' ILE . 89.8 m-85 -153.19 164.46 38.02 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.914 1.686 . . . . 0.0 111.574 -169.879 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 596' ' ' HIS . . . . . 0.43 ' HB2' ' HB2' ' A' ' 599' ' ' CYS . 17.6 m80 -77.83 140.72 39.4 Favored 'General case' 0 N--CA 1.473 0.694 0 O-C-N 121.023 -1.048 . . . . 0.0 108.706 166.204 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 78.3 p -58.4 -42.24 86.69 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 123.657 0.783 . . . . 0.0 112.234 178.304 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 22.8 p -67.92 -47.71 67.99 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 125.533 1.533 . . . . 0.0 113.213 174.854 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 599' ' ' CYS . . . . . 0.43 ' HB2' ' HB2' ' A' ' 596' ' ' HIS . 86.4 m -60.65 -50.63 72.75 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 123.436 0.694 . . . . 0.0 111.493 179.732 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 88.2 t80 -56.07 -45.22 79.39 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 123.291 0.637 . . . . 0.0 112.135 178.227 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 22.7 t-160 -63.67 -46.56 84.99 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 112.939 0.718 . . . . 0.0 112.939 177.736 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 14.9 tm-20 -70.42 -33.4 71.3 Favored 'General case' 0 CA--C 1.543 0.702 0 O-C-N 121.502 -0.749 . . . . 0.0 112.649 -179.642 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 96.0 m . . . . . 0 N--CA 1.475 0.818 0 C-N-CA 124.619 1.168 . . . . 0.0 112.06 177.823 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 14.1 mm . . . . . 0 N--CA 1.476 0.849 0 N-CA-C 112.451 0.537 . . . . 0.0 112.451 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 32.8 ttm180 -61.33 -21.48 64.04 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 125.158 1.383 . . . . 0.0 113.924 178.051 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -71.85 -12.74 75.04 Favored Glycine 0 CA--C 1.539 1.566 0 N-CA-C 115.289 0.876 . . . . 0.0 115.289 177.271 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -70.96 147.91 48.22 Favored 'General case' 0 N--CA 1.478 0.944 0 CA-C-N 118.965 1.383 . . . . 0.0 112.129 177.844 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 46.8 p90 -152.59 165.81 34.01 Favored 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 114.008 1.114 . . . . 0.0 114.008 176.127 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 1.1 m -135.67 139.5 46.22 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.035 0 C-N-CA 126.757 2.023 . . . . 0.0 110.484 174.994 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 55.5 t -69.71 133.09 32.46 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.298 0 O-C-N 120.889 -1.132 . . . . 0.0 111.662 -176.021 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 95.0 t -69.37 124.17 89.91 Favored Pre-proline 0 N--CA 1.476 0.837 0 C-N-CA 124.725 1.21 . . . . 0.0 109.035 170.263 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 93.7 Cg_endo -78.35 143.48 19.68 Favored 'Trans proline' 0 CA--C 1.536 0.596 0 C-N-CA 123.152 2.568 . . . . 0.0 111.977 174.477 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -61.55 -24.76 66.86 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.08 0.952 . . . . 0.0 113.248 -179.559 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 58.6 p -72.18 -26.45 62.07 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 124.7 1.2 . . . . 0.0 113.523 177.207 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 39.7 m -80.85 88.94 5.82 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-N 119.336 0.971 . . . . 0.0 110.829 175.01 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 83.4 mt-30 -56.1 -30.97 62.82 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.205 1.402 . . . . 0.0 113.984 -176.694 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 69.4 m-20 -76.87 -21.73 54.51 Favored 'General case' 0 CA--C 1.545 0.784 0 N-CA-C 113.859 1.059 . . . . 0.0 113.859 178.257 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 66.8 mtp 51.3 32.67 8.62 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 126.105 1.762 . . . . 0.0 113.27 -173.488 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -147.97 154.12 39.91 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 124.691 1.196 . . . . 0.0 113.035 -170.346 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 6.9 t80 -153.94 155.64 36.0 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 124.922 1.289 . . . . 0.0 110.502 173.164 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 3.2 tmmm? -106.58 115.4 30.14 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 125.171 1.388 . . . . 0.0 111.985 -173.695 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 35.5 t -54.37 111.38 2.84 Favored Pre-proline 0 CA--C 1.545 0.768 0 C-N-CA 127.596 2.358 . . . . 0.0 111.279 174.876 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -62.74 -21.52 73.08 Favored 'Trans proline' 0 CA--C 1.539 0.755 0 C-N-CA 123.018 2.478 . . . . 0.0 114.957 178.894 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 96.7 mt -74.54 -57.56 6.34 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 C-N-CA 123.965 0.906 . . . . 0.0 111.164 -176.653 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 16.7 p -102.48 -0.94 31.54 Favored 'General case' 0 CA--C 1.551 0.986 0 N-CA-C 113.784 1.031 . . . . 0.0 113.784 -176.76 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 568' ' ' LYS . . . . . . . . . . . . . 32.9 mmtp 61.27 46.4 7.9 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 127.201 2.2 . . . . 0.0 112.985 -176.795 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 75.7 mt-10 -122.3 136.02 54.83 Favored 'General case' 0 N--CA 1.487 1.405 0 N-CA-C 114.737 1.384 . . . . 0.0 114.737 -173.916 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 79.2 m -83.49 116.85 22.73 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 112.896 0.702 . . . . 0.0 112.896 -179.016 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -85.27 147.56 5.43 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 C-N-CA 124.74 1.216 . . . . 0.0 110.116 167.068 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 58.4 p -133.32 151.37 51.87 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 125.636 1.574 . . . . 0.0 111.25 -179.37 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -70.15 158.53 53.5 Favored Glycine 0 CA--C 1.535 1.327 0 N-CA-C 114.965 0.746 . . . . 0.0 114.965 -176.034 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 9.2 p -140.52 143.37 29.26 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 125.099 1.36 . . . . 0.0 111.763 170.128 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 9.2 t80 -75.07 127.13 32.51 Favored 'General case' 0 CA--C 1.549 0.932 0 N-CA-C 113.905 1.076 . . . . 0.0 113.905 -173.922 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 37.7 t0 -97.85 101.19 12.63 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 125.812 1.645 . . . . 0.0 109.494 168.638 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -63.89 -26.61 68.68 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 124.651 1.181 . . . . 0.0 113.454 -179.194 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 73.2 mm-40 -78.03 -46.06 21.97 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 123.664 0.786 . . . . 0.0 112.468 -178.152 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 71.2 m -77.62 -29.36 51.76 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 123.446 0.698 . . . . 0.0 112.33 173.212 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 81.46 26.82 50.12 Favored Glycine 0 CA--C 1.534 1.257 0 C-N-CA 123.957 0.789 . . . . 0.0 112.963 -175.375 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 79.6 mm-40 -137.68 161.18 37.17 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 126.345 1.858 . . . . 0.0 110.148 -173.034 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 32.6 m95 -96.35 150.26 20.77 Favored 'General case' 0 CA--C 1.54 0.59 0 O-C-N 120.941 -1.1 . . . . 0.0 111.569 175.795 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 9.9 m -135.6 144.9 32.54 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 C-N-CA 125.299 1.44 . . . . 0.0 113.115 -173.686 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 3.2 m0 -92.0 104.86 17.22 Favored 'General case' 0 C--O 1.234 0.276 0 C-N-CA 126.67 1.988 . . . . 0.0 109.411 170.035 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -73.76 152.53 40.32 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 124.679 1.192 . . . . 0.0 112.104 178.421 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 54.73 29.86 12.49 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 125.519 1.527 . . . . 0.0 112.433 -177.662 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 62.0 m -125.05 149.22 48.01 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 124.517 1.127 . . . . 0.0 112.797 -169.303 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 14.9 tt -136.14 145.48 30.83 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.585 0 C-N-CA 127.906 2.482 . . . . 0.0 110.373 177.516 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 71.3 tt0 -107.77 123.48 48.61 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.659 1.184 . . . . 0.0 109.618 169.723 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 7.6 p -157.56 146.27 10.12 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 C-N-CA 124.774 1.23 . . . . 0.0 110.518 -177.028 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 8.2 t-20 52.88 35.19 18.36 Favored 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 124.642 1.177 . . . . 0.0 112.894 -175.649 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 68.67 14.39 67.29 Favored Glycine 0 CA--C 1.536 1.35 0 C-N-CA 125.5 1.524 . . . . 0.0 115.661 -178.291 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 35.9 mtmm -133.31 156.89 46.77 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 125.937 1.695 . . . . 0.0 111.456 -175.671 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 85.8 m-85 -90.74 147.26 23.36 Favored 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 113.001 0.741 . . . . 0.0 113.001 172.588 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 78.4 m-85 -150.44 160.72 43.56 Favored 'General case' 0 C--N 1.329 -0.326 0 C-N-CA 126.235 1.814 . . . . 0.0 110.043 -175.612 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 596' ' ' HIS . . . . . . . . . . . . . 26.0 m80 -75.2 139.08 42.4 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 108.486 -0.931 . . . . 0.0 108.486 167.136 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 59.2 p -59.91 -40.16 87.86 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.634 0.774 . . . . 0.0 111.812 177.653 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 9.4 p -71.25 -36.83 71.92 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 125.693 1.597 . . . . 0.0 113.113 176.72 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 599' ' ' CYS . . . . . . . . . . . . . 69.2 m -64.75 -59.48 4.18 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.353 1.061 . . . . 0.0 111.186 174.795 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 61.7 t80 -53.3 -41.51 65.7 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.363 1.065 . . . . 0.0 113.069 -177.179 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 83.2 t60 -61.4 -34.2 74.95 Favored 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 114.879 1.437 . . . . 0.0 114.879 -177.476 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 35.1 tp10 -102.22 -18.75 15.36 Favored 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 114.196 1.184 . . . . 0.0 114.196 -176.277 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 50.1 m . . . . . 0 N--CA 1.481 1.09 0 N-CA-C 115.993 1.849 . . . . 0.0 115.993 -167.977 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 30.0 mm . . . . . 0 CA--C 1.54 0.582 0 CA-C-O 120.824 0.345 . . . . 0.0 110.891 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 71.4 mtp180 -85.68 -20.8 28.84 Favored 'General case' 0 N--CA 1.481 1.1 0 N-CA-C 113.389 0.885 . . . . 0.0 113.389 -175.279 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -72.63 -10.97 76.92 Favored Glycine 0 CA--C 1.54 1.626 0 C-N-CA 125.467 1.508 . . . . 0.0 114.466 171.686 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 70.1 mmtt -66.34 140.12 58.07 Favored 'General case' 0 N--CA 1.477 0.918 0 CA-C-N 119.089 1.444 . . . . 0.0 111.747 173.271 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 46.1 p90 -153.79 164.86 37.64 Favored 'General case' 0 C--O 1.238 0.467 0 C-N-CA 124.253 1.021 . . . . 0.0 111.723 169.613 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -134.37 135.33 54.21 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 C-N-CA 125.563 1.545 . . . . 0.0 109.736 175.045 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 53.9 t -67.95 133.07 32.21 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.104 0 C-N-CA 123.741 0.816 . . . . 0.0 110.731 -177.349 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 553' ' ' VAL . . . . . 0.451 HG22 ' CD2' ' A' ' 584' ' ' TRP . 5.3 t -84.92 116.17 64.21 Favored Pre-proline 0 CA--C 1.541 0.61 0 C-N-CA 124.117 0.967 . . . . 0.0 109.84 173.805 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -76.69 163.33 31.76 Favored 'Trans proline' 0 CA--C 1.536 0.623 0 C-N-CA 122.509 2.139 . . . . 0.0 112.162 176.887 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 39.8 mm-40 -62.38 -28.64 69.91 Favored 'General case' 0 CA--C 1.548 0.895 0 O-C-N 121.296 -0.878 . . . . 0.0 112.562 173.04 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 69.7 p -67.59 -18.0 64.84 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 125.038 1.335 . . . . 0.0 113.322 175.793 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 18.2 m -80.81 -0.6 39.46 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 114.335 1.235 . . . . 0.0 114.335 169.684 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 88.4 mt-30 45.36 -84.43 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 128.571 2.748 . . . . 0.0 116.621 169.268 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 71.1 m-20 -70.83 -9.35 57.35 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 125.446 1.498 . . . . 0.0 113.914 178.738 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 12.1 mtt 57.99 31.14 20.23 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 126.002 1.721 . . . . 0.0 115.043 178.024 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -122.56 141.84 51.25 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 124.024 0.93 . . . . 0.0 112.943 -177.401 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -149.59 157.84 43.62 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 124.979 1.312 . . . . 0.0 111.436 179.703 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 39.2 ttpt -104.11 144.95 30.88 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 124.795 1.238 . . . . 0.0 114.197 -170.553 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 12.2 t -100.63 107.21 47.64 Favored Pre-proline 0 CA--C 1.541 0.632 0 C-N-CA 126.833 2.053 . . . . 0.0 108.607 166.943 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo -69.96 -16.96 36.91 Favored 'Trans proline' 0 CA--C 1.546 1.097 0 C-N-CA 122.502 2.134 . . . . 0.0 113.443 177.53 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 87.6 mt -72.9 -57.78 6.3 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 C-N-CA 124.12 0.968 . . . . 0.0 111.13 -178.957 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 15.5 p -98.11 -1.93 41.22 Favored 'General case' 0 CA--C 1.552 1.022 0 N-CA-C 113.648 0.981 . . . . 0.0 113.648 179.697 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 568' ' ' LYS . . . . . . . . . . . . . 45.6 tttt 59.73 45.84 12.37 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 126.522 1.929 . . . . 0.0 112.705 -177.736 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 70.3 mm-40 -117.59 166.09 12.79 Favored 'General case' 0 N--CA 1.482 1.149 0 N-CA-C 112.83 0.678 . . . . 0.0 112.83 -178.688 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 89.7 m -112.2 118.53 35.57 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.972 0.909 . . . . 0.0 111.199 179.34 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 3.5 m -79.53 138.58 19.71 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 123.486 0.715 . . . . 0.0 110.26 167.721 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 41.4 p -120.99 142.56 49.67 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 124.818 1.247 . . . . 0.0 110.077 176.307 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -65.92 144.15 46.15 Favored Glycine 0 CA--C 1.533 1.18 0 O-C-N 122.067 -0.395 . . . . 0.0 112.804 178.788 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 86.4 t -129.24 131.95 67.25 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 C-N-CA 125.237 1.415 . . . . 0.0 110.938 -178.901 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 71.5 t80 -71.82 117.49 13.48 Favored 'General case' 0 CA--C 1.549 0.912 0 CA-C-N 118.622 0.647 . . . . 0.0 112.315 -178.395 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 39.7 t0 -84.45 111.01 19.09 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.534 1.134 . . . . 0.0 109.469 169.016 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 54.5 mt-10 -68.9 -24.16 64.28 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 113.672 0.99 . . . . 0.0 113.672 -179.22 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 61.0 mt-10 -77.32 -42.0 38.43 Favored 'General case' 0 N--CA 1.475 0.788 0 O-C-N 121.207 -0.933 . . . . 0.0 112.908 -176.166 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 96.8 p -91.34 -24.74 19.7 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.852 0.861 . . . . 0.0 113.092 172.366 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 82.05 32.16 29.94 Favored Glycine 0 CA--C 1.533 1.159 0 C-N-CA 124.228 0.918 . . . . 0.0 113.124 -178.61 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 61.4 mm-40 -134.49 149.55 50.71 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 125.189 1.396 . . . . 0.0 111.439 -173.881 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 78.4 m95 -79.62 141.7 36.28 Favored 'General case' 0 CA--C 1.535 0.402 0 O-C-N 121.22 -0.925 . . . . 0.0 111.257 171.668 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 21.1 m -137.01 143.85 33.74 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 C-N-CA 125.703 1.601 . . . . 0.0 113.124 -174.973 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 584' ' ' TRP . . . . . 0.451 ' CD2' HG22 ' A' ' 553' ' ' VAL . 2.2 m0 -95.64 102.27 14.05 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 126.561 1.944 . . . . 0.0 107.739 170.37 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -79.32 148.75 31.98 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.873 1.269 . . . . 0.0 112.224 -176.873 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 61.0 t30 52.41 36.27 19.56 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.759 1.624 . . . . 0.0 112.805 -173.174 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 86.4 m -119.55 147.67 44.19 Favored 'General case' 0 N--CA 1.479 0.982 0 O-C-N 120.739 -1.226 . . . . 0.0 112.064 -172.589 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 8.9 tt -145.16 145.49 20.71 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.586 0 C-N-CA 127.312 2.245 . . . . 0.0 110.78 -177.123 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 63.0 tt0 -113.39 128.83 56.59 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.867 1.267 . . . . 0.0 109.417 168.009 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 7.5 p -152.52 135.9 7.8 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.832 0 C-N-CA 125.35 1.46 . . . . 0.0 110.636 -178.058 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 72.4 m-20 53.99 34.01 18.75 Favored 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 124.868 1.267 . . . . 0.0 113.756 -176.129 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 78.02 11.87 84.95 Favored Glycine 0 CA--C 1.537 1.465 0 C-N-CA 124.985 1.279 . . . . 0.0 115.484 -179.899 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -129.86 150.76 51.01 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 125.311 1.444 . . . . 0.0 111.559 -178.528 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 14.2 m-85 -93.48 147.21 23.18 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.611 1.165 . . . . 0.0 112.238 177.749 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 95.3 m-85 -154.08 165.08 37.31 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 126.027 1.731 . . . . 0.0 111.176 -177.248 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 596' ' ' HIS . . . . . 0.431 ' HB2' ' HB2' ' A' ' 599' ' ' CYS . 21.5 m80 -79.32 142.45 36.08 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 108.142 -1.058 . . . . 0.0 108.142 165.424 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 7.8 t -66.56 -39.06 88.33 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 118.997 0.817 . . . . 0.0 112.012 -178.144 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 21.7 p -63.4 -44.53 94.38 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.109 0.963 . . . . 0.0 112.974 171.781 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 599' ' ' CYS . . . . . 0.431 ' HB2' ' HB2' ' A' ' 596' ' ' HIS . 93.1 m -62.32 -50.96 69.56 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.042 0.937 . . . . 0.0 111.044 177.367 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 56.9 t80 -57.37 -43.75 83.84 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 123.778 0.831 . . . . 0.0 111.889 176.517 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 84.4 t60 -62.55 -40.76 97.86 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 123.64 0.776 . . . . 0.0 112.718 178.454 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 73.3 mm-40 -69.28 -36.86 77.52 Favored 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 113.46 0.911 . . . . 0.0 113.46 173.496 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 71.4 m . . . . . 0 N--CA 1.477 0.915 0 C-N-CA 124.077 0.951 . . . . 0.0 112.369 -176.883 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 23.3 mm . . . . . 0 N--CA 1.474 0.756 0 CA-C-O 120.255 0.074 . . . . 0.0 111.173 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 21.2 mmt85 -65.54 -36.65 84.42 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 124.526 1.131 . . . . 0.0 112.321 176.682 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -68.4 -14.27 66.47 Favored Glycine 0 CA--C 1.528 0.901 0 C-N-CA 126.215 1.864 . . . . 0.0 114.278 -179.886 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 65.7 mmtt -76.6 95.26 3.9 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 118.731 1.265 . . . . 0.0 108.659 168.799 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 30.9 p90 -105.91 162.0 13.96 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 113.736 -1.575 . . . . 0.0 111.814 170.353 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 4.3 m -127.85 142.25 44.21 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.617 0 C-N-CA 125.912 1.685 . . . . 0.0 109.803 172.042 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 94.5 t -69.19 135.32 28.59 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 O-C-N 121.606 -0.684 . . . . 0.0 110.742 -176.656 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 97.5 t -68.98 119.73 71.67 Favored Pre-proline 0 CA--C 1.545 0.752 0 C-N-CA 124.04 0.936 . . . . 0.0 108.985 173.283 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo -76.21 154.67 37.07 Favored 'Trans proline' 0 CA--C 1.535 0.568 0 C-N-CA 123.189 2.593 . . . . 0.0 112.472 -177.556 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 17.3 pt-20 -65.3 -17.29 64.39 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 113.199 0.814 . . . . 0.0 113.199 173.779 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 77.4 p -73.09 -22.39 60.58 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.113 0.965 . . . . 0.0 113.005 173.807 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 30.5 t -79.2 110.38 14.41 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 119.281 0.946 . . . . 0.0 110.889 173.578 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 26.5 mp0 -71.95 -31.11 66.0 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.208 1.003 . . . . 0.0 112.53 -178.635 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 66.6 m-20 -108.71 -2.8 18.36 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 125.508 1.523 . . . . 0.0 113.998 -174.793 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 7.4 mtt 55.22 37.53 29.04 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.524 1.53 . . . . 0.0 112.889 -171.718 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -133.02 142.19 48.68 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.312 1.045 . . . . 0.0 113.292 -173.338 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 28.0 t80 -152.63 159.76 43.2 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 125.799 1.64 . . . . 0.0 109.789 174.09 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 38.8 ttmt -118.16 134.71 54.75 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 124.583 1.153 . . . . 0.0 113.737 -170.429 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 19.6 t -73.03 116.78 53.96 Favored Pre-proline 0 CA--C 1.541 0.617 0 C-N-CA 126.104 1.762 . . . . 0.0 110.509 169.308 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 93.2 Cg_endo -71.77 -18.04 28.8 Favored 'Trans proline' 0 CA--C 1.543 0.951 0 C-N-CA 122.892 2.394 . . . . 0.0 113.974 173.315 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 73.6 mt -72.04 -56.67 9.37 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 C-N-CA 123.948 0.899 . . . . 0.0 110.413 -177.456 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 15.6 p -100.99 -0.67 36.11 Favored 'General case' 0 CA--C 1.552 1.055 0 N-CA-C 113.911 1.078 . . . . 0.0 113.911 178.994 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 568' ' ' LYS . . . . . . . . . . . . . 33.6 tttt 63.73 39.61 8.42 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 126.644 1.978 . . . . 0.0 113.824 -179.041 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 78.6 mm-40 -123.59 138.49 54.54 Favored 'General case' 0 N--CA 1.481 1.099 0 N-CA-C 114.136 1.161 . . . . 0.0 114.136 -171.976 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 80.5 m -83.64 122.48 28.66 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 124.589 1.155 . . . . 0.0 112.42 -179.28 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 1.7 t -79.33 141.49 15.29 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 C-N-CA 124.715 1.206 . . . . 0.0 109.223 168.106 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 43.1 p -113.66 138.72 49.81 Favored 'General case' 0 N--CA 1.475 0.825 0 C-N-CA 124.67 1.188 . . . . 0.0 109.997 169.28 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -65.97 150.8 51.94 Favored Glycine 0 CA--C 1.535 1.287 0 C-N-CA 124.756 1.169 . . . . 0.0 113.756 -178.44 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 84.3 t -138.05 133.7 44.31 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.858 0 C-N-CA 125.747 1.619 . . . . 0.0 111.598 -176.291 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 70.2 t80 -69.27 141.75 54.29 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-N 119.742 1.156 . . . . 0.0 113.039 179.067 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -126.6 130.64 50.9 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.543 1.137 . . . . 0.0 111.445 172.788 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 80.9 mt-10 -71.72 -25.79 62.22 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 113.541 0.941 . . . . 0.0 113.541 176.848 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -74.23 -42.13 60.23 Favored 'General case' 0 N--CA 1.479 1.023 0 CA-C-N 118.98 0.809 . . . . 0.0 111.481 177.859 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 33.1 m -75.11 -31.57 61.17 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 124.302 1.041 . . . . 0.0 112.029 171.037 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 71.39 22.25 78.59 Favored Glycine 0 CA--C 1.534 1.226 0 C-N-CA 123.959 0.79 . . . . 0.0 112.265 -169.74 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -153.82 166.95 31.29 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 126.382 1.873 . . . . 0.0 112.13 -169.406 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 70.2 m95 -76.69 142.99 40.34 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.728 1.211 . . . . 0.0 111.893 175.718 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 28.9 m -139.74 148.09 23.4 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 C-N-CA 126.663 1.985 . . . . 0.0 112.086 -172.906 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 4.7 m0 -97.71 98.98 10.33 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 127.386 2.275 . . . . 0.0 107.598 170.851 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 66.3 mttm -75.22 154.4 37.57 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 124.412 1.085 . . . . 0.0 111.525 179.808 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 62.1 t30 49.59 40.23 19.0 Favored 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 125.087 1.355 . . . . 0.0 112.411 -174.509 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 96.8 m -130.12 137.94 50.41 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 124.835 1.254 . . . . 0.0 111.383 -175.921 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 11.1 tt -133.75 140.13 47.2 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 C-N-CA 126.363 1.865 . . . . 0.0 112.121 -168.989 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 69.2 tt0 -97.51 132.34 43.29 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.502 1.121 . . . . 0.0 110.621 169.863 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 7.7 p -145.79 127.57 8.35 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.616 0 C-N-CA 125.352 1.461 . . . . 0.0 111.02 171.985 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 61.9 m-20 53.3 36.81 23.75 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 124.993 1.317 . . . . 0.0 113.828 175.372 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 79.67 8.5 87.67 Favored Glycine 0 CA--C 1.539 1.575 0 C-N-CA 124.67 1.129 . . . . 0.0 115.383 -179.368 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 58.9 mtmt -123.5 160.69 26.41 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 126.29 1.836 . . . . 0.0 111.114 178.247 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 75.3 m-85 -113.27 143.19 44.84 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 124.177 0.991 . . . . 0.0 113.635 179.832 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 21.5 m-30 -139.93 171.82 13.66 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 128.247 2.619 . . . . 0.0 109.77 179.709 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 596' ' ' HIS . . . . . 0.435 ' HB2' ' HB2' ' A' ' 599' ' ' CYS . 20.0 m80 -83.79 143.05 30.22 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 107.976 -1.12 . . . . 0.0 107.976 166.409 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 11.3 m -65.26 -41.35 94.35 Favored 'General case' 0 N--CA 1.473 0.68 0 O-C-N 122.089 -0.382 . . . . 0.0 111.897 -176.72 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 21.3 p -65.55 -42.01 92.36 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-O 118.561 -0.733 . . . . 0.0 112.843 171.84 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 599' ' ' CYS . . . . . 0.435 ' HB2' ' HB2' ' A' ' 596' ' ' HIS . 67.4 m -59.83 -54.02 51.17 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 119.301 0.955 . . . . 0.0 111.605 178.883 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -54.73 -51.83 64.4 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 123.246 0.618 . . . . 0.0 109.929 175.093 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 85.8 t60 -56.71 -45.86 81.61 Favored 'General case' 0 N--CA 1.47 0.542 0 N-CA-C 114.222 1.193 . . . . 0.0 114.222 -179.607 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -80.49 -26.91 37.92 Favored 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 113.946 1.091 . . . . 0.0 113.946 -179.176 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 93.0 m . . . . . 0 N--CA 1.482 1.128 0 C-N-CA 123.936 0.895 . . . . 0.0 112.109 -177.854 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 22.3 mm . . . . . 0 N--CA 1.476 0.849 0 N-CA-C 113.032 0.753 . . . . 0.0 113.032 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 23.4 ptt180 -72.11 -17.79 61.95 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 113.661 0.986 . . . . 0.0 113.661 -176.625 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -75.62 -11.39 84.47 Favored Glycine 0 CA--C 1.535 1.33 0 C-N-CA 124.856 1.217 . . . . 0.0 114.165 -178.071 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -70.56 131.69 44.37 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 118.565 1.182 . . . . 0.0 110.732 174.766 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 50.0 p90 -140.58 163.94 31.51 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 124.79 1.236 . . . . 0.0 111.967 174.624 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 21.3 m -127.92 143.29 41.28 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 C-N-CA 126.004 1.721 . . . . 0.0 109.733 172.689 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 92.3 t -69.67 134.61 29.84 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.149 0 O-C-N 120.662 -1.274 . . . . 0.0 109.747 175.644 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 85.7 t -63.27 122.96 78.83 Favored Pre-proline 0 CA--C 1.544 0.746 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 179.137 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -72.85 151.07 50.61 Favored 'Trans proline' 0 CA--C 1.538 0.681 0 C-N-CA 122.572 2.182 . . . . 0.0 112.684 -175.595 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 16.0 pt-20 -62.61 -21.01 65.32 Favored 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 113.87 1.063 . . . . 0.0 113.87 179.359 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 45.8 p -74.68 -30.18 61.48 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 125.629 1.572 . . . . 0.0 113.208 176.014 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 62.3 m -87.19 79.76 8.49 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 123.617 0.767 . . . . 0.0 112.006 -177.911 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 85.9 mt-30 -58.4 -32.97 69.13 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 125.138 1.375 . . . . 0.0 113.501 -177.702 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 16.6 t0 -77.65 -12.47 59.97 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 124.764 1.226 . . . . 0.0 113.297 176.604 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 6.5 mtt 52.75 35.99 20.02 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 126.135 1.774 . . . . 0.0 113.364 -175.978 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -142.05 149.73 40.33 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.364 1.065 . . . . 0.0 112.47 -178.221 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 9.3 t80 -153.32 155.24 36.12 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 124.01 0.924 . . . . 0.0 110.825 177.329 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 28.3 ttpp -99.85 134.31 42.95 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 123.969 0.908 . . . . 0.0 113.27 -175.47 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 40.7 t -76.27 116.13 53.34 Favored Pre-proline 0 CA--C 1.541 0.614 0 C-N-CA 127.006 2.122 . . . . 0.0 110.622 169.286 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -62.66 -28.31 76.67 Favored 'Trans proline' 0 CA--C 1.542 0.901 0 C-N-CA 122.708 2.272 . . . . 0.0 114.597 175.686 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 87.3 mt -70.6 -60.47 2.41 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.2 0 CA-C-N 118.845 0.748 . . . . 0.0 111.427 -174.54 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 15.6 p -93.72 -1.99 54.39 Favored 'General case' 0 CA--C 1.549 0.929 0 N-CA-C 113.596 0.961 . . . . 0.0 113.596 179.837 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 568' ' ' LYS . . . . . . . . . . . . . 2.2 mptp? 60.48 43.47 13.06 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 126.959 2.104 . . . . 0.0 112.205 -177.417 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 75.0 mm-40 -123.31 140.73 52.71 Favored 'General case' 0 N--CA 1.482 1.134 0 N-CA-C 114.401 1.26 . . . . 0.0 114.401 -173.645 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 97.5 m -82.06 116.74 21.79 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 123.863 0.865 . . . . 0.0 111.817 179.078 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 2.9 p -79.56 149.47 5.36 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.885 0 C-N-CA 124.411 1.084 . . . . 0.0 110.076 167.949 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 44.5 p -126.07 142.8 51.37 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 124.816 1.246 . . . . 0.0 111.319 -179.376 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -72.81 147.11 39.48 Favored Glycine 0 CA--C 1.529 0.932 0 C-N-CA 124.758 1.171 . . . . 0.0 112.893 -178.291 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 62.5 t -135.09 130.23 51.47 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.421 0 C-N-CA 124.583 1.153 . . . . 0.0 111.749 -178.979 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 68.5 t80 -68.39 115.78 8.21 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 122.993 0.517 . . . . 0.0 112.078 178.354 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 37.2 t0 -86.44 119.4 26.66 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 123.89 0.876 . . . . 0.0 110.006 169.386 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 63.7 mt-10 -69.25 -23.1 63.81 Favored 'General case' 0 CA--C 1.548 0.869 0 N-CA-C 113.2 0.815 . . . . 0.0 113.2 177.18 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 8.4 tm-20 -79.78 -47.76 14.69 Favored 'General case' 0 CA--C 1.541 0.61 0 O-C-N 121.211 -0.931 . . . . 0.0 111.724 -179.38 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 47.7 m -71.94 -28.42 63.45 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.775 0.83 . . . . 0.0 112.379 169.953 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 75.21 24.27 71.71 Favored Glycine 0 CA--C 1.533 1.212 0 C-N-CA 124.686 1.136 . . . . 0.0 113.933 -173.538 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -148.13 159.86 43.49 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 125.983 1.713 . . . . 0.0 111.812 -170.791 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 73.7 m95 -76.87 139.69 40.34 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 123.922 0.889 . . . . 0.0 111.731 -179.894 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 16.8 m -132.87 150.43 32.95 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 126.039 1.736 . . . . 0.0 112.591 -179.181 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 7.8 m0 -100.15 101.43 12.47 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 127.409 2.283 . . . . 0.0 107.829 173.079 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 73.8 mmtt -70.71 151.75 44.57 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 124.986 1.314 . . . . 0.0 111.56 -178.688 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 59.4 t30 49.57 40.4 19.3 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 125.442 1.497 . . . . 0.0 112.962 -177.862 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 99.9 m -123.86 147.74 47.37 Favored 'General case' 0 N--CA 1.485 1.309 0 O-C-N 121.005 -1.06 . . . . 0.0 112.476 -171.232 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 16.4 tt -142.55 148.73 19.67 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.631 0 C-N-CA 127.75 2.42 . . . . 0.0 110.049 -178.169 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 69.5 tt0 -108.34 130.47 55.2 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.421 1.088 . . . . 0.0 110.784 170.294 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 9.4 p -153.31 145.47 14.79 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.911 0 C-N-CA 125.06 1.344 . . . . 0.0 110.503 177.069 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 8.1 t-20 53.59 30.94 11.62 Favored 'General case' 0 CA--C 1.552 1.028 0 C-N-CA 124.944 1.297 . . . . 0.0 113.571 -177.655 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 76.6 11.22 85.43 Favored Glycine 0 CA--C 1.539 1.585 0 C-N-CA 124.976 1.274 . . . . 0.0 115.916 -179.323 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -135.25 161.03 36.55 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 125.914 1.686 . . . . 0.0 112.365 -179.75 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 69.6 m-85 -90.05 150.24 22.18 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 113.684 0.994 . . . . 0.0 113.684 178.258 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 89.1 m-85 -149.94 163.28 38.51 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 127.382 2.273 . . . . 0.0 109.955 -176.63 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 596' ' ' HIS . . . . . 0.403 ' HB2' ' HB2' ' A' ' 599' ' ' CYS . 29.4 m80 -81.07 140.61 35.0 Favored 'General case' 0 N--CA 1.471 0.602 0 O-C-N 121.343 -0.848 . . . . 0.0 109.224 168.716 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 23.6 t -62.62 -45.43 92.88 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 123.353 0.661 . . . . 0.0 112.02 -178.695 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 24.5 p -63.36 -44.34 95.1 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 123.871 0.868 . . . . 0.0 112.777 173.929 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 599' ' ' CYS . . . . . 0.403 ' HB2' ' HB2' ' A' ' 596' ' ' HIS . 97.2 m -57.77 -53.57 56.72 Favored 'General case' 0 CA--C 1.544 0.72 0 CA-C-N 119.134 0.879 . . . . 0.0 111.404 176.897 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 80.9 t80 -57.82 -45.79 85.63 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.335 1.054 . . . . 0.0 112.308 177.367 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 48.1 t-80 -62.9 -43.05 99.84 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 124.005 0.922 . . . . 0.0 113.011 177.628 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 62.9 mt-10 -73.0 -30.38 63.74 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 123.867 0.867 . . . . 0.0 113.117 178.342 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 51.5 m . . . . . 0 N--CA 1.477 0.921 0 C-N-CA 124.267 1.027 . . . . 0.0 112.13 175.01 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 24.0 mm . . . . . 0 N--CA 1.479 1.003 0 N-CA-C 111.324 0.12 . . . . 0.0 111.324 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 88.8 mtt-85 -70.1 -30.38 67.59 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 124.105 0.962 . . . . 0.0 112.959 176.905 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -79.73 -9.47 86.77 Favored Glycine 0 CA--C 1.536 1.369 0 C-N-CA 125.637 1.589 . . . . 0.0 114.535 178.572 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 58.9 mtpt -75.64 132.62 40.73 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.719 1.207 . . . . 0.0 111.154 177.063 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 23.5 p90 -153.3 166.55 32.24 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 125.234 1.414 . . . . 0.0 111.387 176.141 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -130.89 133.72 62.69 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 C-N-CA 124.915 1.286 . . . . 0.0 110.483 175.671 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 73.4 t -64.15 134.34 29.04 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 C-N-CA 124.168 0.987 . . . . 0.0 110.405 -178.152 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 59.0 t -70.97 116.5 47.07 Favored Pre-proline 0 CA--C 1.544 0.739 0 CA-C-O 118.627 -0.702 . . . . 0.0 109.467 173.741 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -83.37 154.8 14.21 Favored 'Trans proline' 0 N--CA 1.457 -0.642 0 C-N-CA 123.546 2.831 . . . . 0.0 111.607 179.949 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 3.9 pm0 -64.37 -22.39 66.94 Favored 'General case' 0 N--CA 1.471 0.577 0 O-C-N 121.089 -1.007 . . . . 0.0 112.675 174.435 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 67.6 p -71.85 -17.65 62.12 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 125.131 1.372 . . . . 0.0 113.064 175.936 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 61.0 p -74.05 -35.53 64.29 Favored 'General case' 0 N--CA 1.48 1.066 0 CA-C-N 119.278 0.945 . . . . 0.0 112.177 175.811 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 57.3 tt0 59.76 -49.17 0.08 Allowed 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 129.94 3.296 . . . . 0.0 115.994 -177.366 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 71.8 m-20 -80.23 -11.15 59.76 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.6 1.56 . . . . 0.0 113.883 177.719 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 63.5 mtp 57.59 27.19 13.8 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 125.889 1.675 . . . . 0.0 114.517 -179.3 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -145.83 147.65 32.05 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.327 1.051 . . . . 0.0 113.483 -175.421 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 40.2 m-85 -149.79 164.97 33.87 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 127.051 2.14 . . . . 0.0 110.276 175.304 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 38.1 ttmt -114.09 132.04 56.18 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 124.496 1.119 . . . . 0.0 112.815 -177.881 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 13.1 t -66.94 112.67 10.34 Favored Pre-proline 0 CA--C 1.542 0.655 0 C-N-CA 126.284 1.834 . . . . 0.0 109.744 168.437 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -70.16 -18.87 34.84 Favored 'Trans proline' 0 CA--C 1.54 0.796 0 C-N-CA 122.5 2.134 . . . . 0.0 113.024 176.494 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 36.5 mt -70.93 -50.11 45.32 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 C-N-CA 124.839 1.256 . . . . 0.0 110.968 -175.886 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 15.6 p -108.55 -2.09 19.15 Favored 'General case' 0 CA--C 1.552 1.028 0 C-N-CA 124.906 1.283 . . . . 0.0 113.607 178.425 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 568' ' ' LYS . . . . . . . . . . . . . 96.0 mttt 60.44 46.59 9.63 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 126.913 2.085 . . . . 0.0 112.697 -177.507 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 72.1 mm-40 -126.04 141.88 51.76 Favored 'General case' 0 N--CA 1.481 1.078 0 N-CA-C 114.688 1.366 . . . . 0.0 114.688 -176.975 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 93.7 m -86.23 130.56 34.48 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 123.781 0.832 . . . . 0.0 112.979 -176.535 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 3.0 m -94.78 151.43 3.82 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.891 0 C-N-CA 125.779 1.631 . . . . 0.0 111.088 167.514 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 65.8 p -134.15 149.52 51.05 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 125.414 1.486 . . . . 0.0 111.27 178.158 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -67.69 143.8 42.67 Favored Glycine 0 CA--C 1.536 1.363 0 C-N-CA 124.219 0.914 . . . . 0.0 114.868 -177.42 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 98.8 t -139.67 136.0 39.51 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 125.596 1.558 . . . . 0.0 112.091 -179.703 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 75.2 t80 -73.25 123.58 23.99 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 120.241 1.382 . . . . 0.0 112.97 -177.262 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 16.1 t0 -91.62 123.01 34.7 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 125.641 1.576 . . . . 0.0 111.274 169.979 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -72.37 -24.59 61.29 Favored 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 114.131 1.16 . . . . 0.0 114.131 177.125 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -73.84 -53.74 9.55 Favored 'General case' 0 N--CA 1.476 0.826 0 CA-C-N 119.09 0.859 . . . . 0.0 111.661 -176.299 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 15.4 t -78.6 -27.46 45.55 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 123.831 0.853 . . . . 0.0 112.201 172.749 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 79.45 32.54 37.83 Favored Glycine 0 CA--C 1.532 1.144 0 C-N-CA 124.032 0.825 . . . . 0.0 113.2 -175.754 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 77.6 mm-40 -141.49 155.92 45.79 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.73 1.612 . . . . 0.0 111.777 -170.421 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 79.7 m95 -76.08 138.32 40.74 Favored 'General case' 0 CA--C 1.534 0.358 0 O-C-N 120.967 -1.083 . . . . 0.0 111.468 173.584 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 18.7 m -138.8 151.03 23.62 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.019 0 C-N-CA 126.657 1.983 . . . . 0.0 113.002 -173.273 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 4.3 m0 -94.93 104.19 16.07 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 126.376 1.87 . . . . 0.0 108.639 168.632 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 53.9 mtmt -69.5 145.87 52.34 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 124.305 1.042 . . . . 0.0 111.443 -177.487 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 48.0 t30 48.96 44.76 22.65 Favored 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 125.326 1.45 . . . . 0.0 112.194 -178.236 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 87.9 m -131.77 146.35 52.1 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 124.528 1.131 . . . . 0.0 111.993 -173.058 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 13.0 tt -139.66 151.79 22.53 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.724 0 C-N-CA 127.967 2.507 . . . . 0.0 109.979 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 81.0 tt0 -107.93 117.77 35.01 Favored 'General case' 0 N--CA 1.472 0.67 0 O-C-N 120.889 -1.132 . . . . 0.0 110.734 172.099 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 5.0 t -144.18 138.38 24.13 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 C-N-CA 125.511 1.524 . . . . 0.0 110.506 -175.567 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 14.5 m120 54.39 34.49 20.9 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 124.973 1.309 . . . . 0.0 113.678 -179.57 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 75.77 11.27 84.68 Favored Glycine 0 CA--C 1.536 1.4 0 C-N-CA 124.773 1.178 . . . . 0.0 115.58 -179.329 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 64.1 mttp -132.21 157.08 45.24 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 125.96 1.704 . . . . 0.0 111.614 -179.298 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 74.8 m-85 -88.38 130.97 35.02 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 121.685 0.755 . . . . 0.0 111.566 174.241 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 12.1 m-30 -124.72 156.68 37.25 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 127.104 2.162 . . . . 0.0 109.696 -176.523 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 596' ' ' HIS . . . . . 0.406 ' HB2' ' HB2' ' A' ' 599' ' ' CYS . 29.6 m80 -79.87 140.98 36.55 Favored 'General case' 0 N--CA 1.47 0.573 0 O-C-N 120.837 -1.164 . . . . 0.0 108.184 167.085 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 19.1 m -66.8 -38.31 86.26 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 118.841 0.746 . . . . 0.0 112.262 -179.251 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 23.4 p -65.65 -37.86 87.72 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 123.872 0.869 . . . . 0.0 113.187 172.042 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 599' ' ' CYS . . . . . 0.406 ' HB2' ' HB2' ' A' ' 596' ' ' HIS . 68.0 m -61.71 -58.63 7.28 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 123.881 0.872 . . . . 0.0 110.089 172.7 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 58.1 t80 -53.48 -39.64 64.69 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 125.329 1.452 . . . . 0.0 113.517 -179.782 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 82.1 t60 -60.79 -27.16 67.81 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 113.85 1.056 . . . . 0.0 113.85 177.619 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 57.7 mm-40 -109.36 -7.95 15.14 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 125.571 1.549 . . . . 0.0 114.258 -179.958 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 19.3 m . . . . . 0 N--CA 1.476 0.85 0 C-N-CA 124.572 1.149 . . . . 0.0 113.082 -173.857 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 34.9 mm . . . . . 0 CA--C 1.547 0.835 0 N-CA-C 111.824 0.305 . . . . 0.0 111.824 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . 0.269 0.0 OUTLIER -76.27 -13.94 60.14 Favored 'General case' 0 N--CA 1.486 1.347 0 O-C-N 120.505 -1.372 . . . . 0.0 113.54 175.856 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -70.6 -12.95 70.91 Favored Glycine 0 CA--C 1.537 1.414 0 C-N-CA 124.751 1.167 . . . . 0.0 113.9 170.914 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 32.0 mmtp -75.03 127.6 33.61 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 118.767 1.283 . . . . 0.0 110.364 171.245 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 39.9 p90 -149.62 164.24 35.68 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 123.854 0.861 . . . . 0.0 112.713 173.737 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -134.24 133.15 55.63 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 C-N-CA 126.15 1.78 . . . . 0.0 109.644 174.634 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 53.8 t -67.23 135.28 28.83 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.94 0 C-N-CA 123.774 0.83 . . . . 0.0 110.834 -176.72 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 19.0 t -74.28 116.21 50.58 Favored Pre-proline 0 N--CA 1.474 0.729 0 N-CA-C 108.518 -0.919 . . . . 0.0 108.518 171.523 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_endo -77.05 151.13 30.33 Favored 'Trans proline' 0 N--CA 1.458 -0.586 0 C-N-CA 122.752 2.301 . . . . 0.0 111.302 175.456 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -62.65 -22.36 66.38 Favored 'General case' 0 N--CA 1.477 0.876 0 O-C-N 121.376 -0.827 . . . . 0.0 112.942 175.069 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 20.6 m -64.32 -28.32 69.63 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 125.353 1.461 . . . . 0.0 113.487 171.685 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 42.3 t -78.14 125.97 30.13 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 123.934 0.894 . . . . 0.0 112.181 179.639 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 1.7 pm0 -81.31 152.66 27.45 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.363 1.065 . . . . 0.0 111.868 170.197 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 36.3 m-20 60.75 -11.93 0.05 OUTLIER 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 127.642 2.377 . . . . 0.0 117.365 176.848 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 46.9 mtp 57.34 32.76 22.29 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 126.098 1.759 . . . . 0.0 114.194 173.448 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -151.33 155.54 38.92 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.827 1.251 . . . . 0.0 112.797 -171.674 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -152.97 154.44 34.99 Favored 'General case' 0 CA--C 1.542 0.673 0 N-CA-C 113.09 0.774 . . . . 0.0 113.09 173.237 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 14.5 tptm -77.88 142.0 38.74 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 125.107 1.363 . . . . 0.0 113.226 -178.116 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 14.8 t -94.45 107.25 28.47 Favored Pre-proline 0 CA--C 1.539 0.554 0 C-N-CA 125.165 1.386 . . . . 0.0 108.979 167.736 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 63.9 Cg_endo -67.66 -19.58 47.67 Favored 'Trans proline' 0 CA--C 1.542 0.905 0 C-N-CA 122.162 1.908 . . . . 0.0 113.529 175.851 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 89.0 mt -73.48 -56.86 8.12 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 C-N-CA 124.365 1.066 . . . . 0.0 111.178 -176.473 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 14.9 p -100.17 0.3 40.25 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 124.488 1.115 . . . . 0.0 113.794 179.242 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 568' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 59.58 44.32 14.73 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 126.818 2.047 . . . . 0.0 112.122 -179.423 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 74.7 mm-40 -115.59 -175.35 2.7 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 123.774 0.83 . . . . 0.0 112.154 179.857 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 60.6 m -125.6 128.66 48.24 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 124.403 1.081 . . . . 0.0 110.586 172.078 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 2.3 p -91.83 147.15 5.49 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 C-N-CA 124.357 1.063 . . . . 0.0 111.062 170.161 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 64.3 p -133.4 145.91 50.74 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 124.826 1.25 . . . . 0.0 111.753 -175.299 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -72.04 153.6 49.98 Favored Glycine 0 CA--C 1.537 1.413 0 C-N-CA 124.275 0.941 . . . . 0.0 113.63 -179.939 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 8.8 p -142.69 138.06 28.13 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 C-N-CA 124.362 1.065 . . . . 0.0 112.383 177.972 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 68.9 t80 -71.71 118.37 14.46 Favored 'General case' 0 CA--C 1.544 0.732 0 O-C-N 121.497 -0.752 . . . . 0.0 112.295 -178.364 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 21.8 t0 -85.22 120.9 27.23 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.32 1.048 . . . . 0.0 110.493 170.158 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 53.2 mt-10 -74.36 -22.91 59.0 Favored 'General case' 0 CA--C 1.54 0.565 0 N-CA-C 113.765 1.024 . . . . 0.0 113.765 -178.812 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 34.1 mm-40 -76.52 -51.17 12.22 Favored 'General case' 0 N--CA 1.476 0.849 0 CA-C-N 119.467 1.03 . . . . 0.0 112.998 177.203 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 15.7 t -75.07 -27.44 59.94 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 123.47 0.708 . . . . 0.0 112.071 173.736 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 75.49 32.18 55.32 Favored Glycine 0 CA--C 1.535 1.324 0 C-N-CA 124.829 1.204 . . . . 0.0 112.655 -175.002 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -143.94 150.44 38.35 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 125.506 1.522 . . . . 0.0 112.133 -170.863 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 84.7 m95 -73.71 138.97 45.0 Favored 'General case' 0 CA--C 1.537 0.474 0 O-C-N 121.288 -0.883 . . . . 0.0 111.904 175.429 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 5.5 m -134.84 141.58 42.72 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 C-N-CA 126.115 1.766 . . . . 0.0 112.9 -177.419 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 4.7 m0 -87.51 102.94 15.06 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.739 1.616 . . . . 0.0 108.854 169.338 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 73.5 mmtt -72.8 147.54 45.4 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 123.867 0.867 . . . . 0.0 111.628 -178.581 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 51.3 t30 50.45 43.76 27.0 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.959 1.304 . . . . 0.0 112.271 -177.983 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 93.0 m -126.2 147.19 49.71 Favored 'General case' 0 N--CA 1.48 1.057 0 O-C-N 120.774 -1.203 . . . . 0.0 112.899 -172.095 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 5.6 tt -139.65 144.87 27.75 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.672 0 C-N-CA 127.663 2.385 . . . . 0.0 109.668 179.964 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 87.0 tt0 -117.46 121.04 39.96 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 124.977 1.311 . . . . 0.0 110.198 173.47 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 5.2 t -142.88 131.16 19.96 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.509 0 C-N-CA 125.96 1.704 . . . . 0.0 109.746 -175.164 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 71.5 m-20 52.22 44.72 29.45 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 125.223 1.409 . . . . 0.0 112.737 174.953 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 73.33 9.85 77.93 Favored Glycine 0 CA--C 1.536 1.363 0 C-N-CA 125.157 1.36 . . . . 0.0 115.507 178.915 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 35.9 mtmm -128.58 151.86 48.97 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 126.085 1.754 . . . . 0.0 112.007 -176.415 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 69.4 m-85 -96.72 148.59 22.73 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 124.098 0.959 . . . . 0.0 112.88 174.211 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 65.3 m-85 -149.13 160.1 43.65 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.177 1.391 . . . . 0.0 110.578 177.748 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 596' ' ' HIS . . . . . . . . . . . . . 20.8 m170 -75.19 142.23 43.5 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 167.628 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 8.7 t -67.54 -42.23 83.0 Favored 'General case' 0 N--CA 1.469 0.505 0 O-C-N 121.388 -0.82 . . . . 0.0 111.867 -179.273 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 21.6 p -60.32 -38.76 84.74 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.661 0.785 . . . . 0.0 113.096 173.471 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 599' ' ' CYS . . . . . . . . . . . . . 95.1 m -68.35 -57.61 5.65 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.161 0.984 . . . . 0.0 110.727 177.385 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 54.7 t80 -65.56 -33.51 76.09 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 113.064 0.764 . . . . 0.0 113.064 -175.246 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 82.0 t60 -58.18 -36.88 73.71 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 124.742 1.217 . . . . 0.0 113.108 175.315 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 94.8 mt-10 -89.78 -26.26 20.68 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 113.648 0.981 . . . . 0.0 113.648 176.329 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 83.0 m . . . . . 0 N--CA 1.478 0.942 0 C-N-CA 124.121 0.968 . . . . 0.0 113.096 -175.037 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 5.9 mm . . . . . 0 N--CA 1.478 0.928 0 CA-C-O 120.513 0.197 . . . . 0.0 111.212 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 38.4 ptt180 -64.4 -22.68 67.03 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 125.145 1.378 . . . . 0.0 114.148 176.816 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -81.25 -9.36 86.11 Favored Glycine 0 CA--C 1.533 1.164 0 C-N-CA 125.63 1.586 . . . . 0.0 114.47 -177.597 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -70.45 143.62 51.72 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 118.348 1.074 . . . . 0.0 110.684 173.336 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 38.9 p90 -151.46 165.68 33.44 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 124.09 0.956 . . . . 0.0 112.528 177.576 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -131.16 134.14 61.68 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 C-N-CA 125.612 1.565 . . . . 0.0 110.137 174.326 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 10.8 p -70.6 133.67 31.43 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 C-N-CA 123.723 0.809 . . . . 0.0 110.965 -176.164 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 5.1 t -85.24 120.26 73.18 Favored Pre-proline 0 C--O 1.238 0.493 0 C-N-CA 125.101 1.36 . . . . 0.0 110.321 173.824 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -76.5 146.25 27.29 Favored 'Trans proline' 0 C--N 1.352 0.713 0 C-N-CA 122.28 1.987 . . . . 0.0 111.146 169.583 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -62.92 -23.49 67.39 Favored 'General case' 0 N--CA 1.476 0.858 0 O-C-N 121.444 -0.785 . . . . 0.0 112.794 179.283 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 67.7 p -68.73 -18.23 64.2 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 125.49 1.516 . . . . 0.0 113.934 172.851 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 15.3 t -74.99 43.17 0.2 Allowed 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 124.881 1.272 . . . . 0.0 114.271 174.758 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 55.6 tt0 46.84 -99.13 0.04 OUTLIER 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 127.841 2.456 . . . . 0.0 114.226 170.121 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 79.7 m-20 -94.79 4.66 53.56 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 125.719 1.607 . . . . 0.0 114.712 -174.741 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 13.9 mtt 57.98 36.99 26.63 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 124.891 1.277 . . . . 0.0 114.083 -179.811 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -138.76 152.51 47.99 Favored 'General case' 0 CA--C 1.54 0.589 0 O-C-N 120.713 -1.242 . . . . 0.0 114.277 -176.584 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 17.6 t80 -151.06 174.15 13.52 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 126.139 1.776 . . . . 0.0 109.391 172.615 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 7.0 ttpm? -125.0 129.51 50.46 Favored 'General case' 0 N--CA 1.481 1.106 0 CA-C-N 120.702 1.592 . . . . 0.0 112.846 179.222 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 49.0 t -65.07 117.79 42.97 Favored Pre-proline 0 CA--C 1.538 0.482 0 C-N-CA 126.521 1.928 . . . . 0.0 111.032 172.778 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -63.96 -27.33 66.43 Favored 'Trans proline' 0 CA--C 1.54 0.791 0 C-N-CA 123.037 2.492 . . . . 0.0 115.114 176.437 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 97.0 mt -74.44 -55.18 12.83 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 124.174 0.989 . . . . 0.0 111.606 -172.492 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 15.3 p -100.74 -0.18 37.72 Favored 'General case' 0 CA--C 1.553 1.059 0 C-N-CA 124.287 1.035 . . . . 0.0 113.449 179.41 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 568' ' ' LYS . . . . . . . . . . . . . 1.6 mptp? 59.3 44.37 15.5 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 126.351 1.86 . . . . 0.0 112.041 -179.448 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 64.8 mm-40 -118.09 135.84 53.95 Favored 'General case' 0 N--CA 1.481 1.121 0 N-CA-C 114.312 1.227 . . . . 0.0 114.312 -173.954 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 94.0 m -76.13 116.11 16.51 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 123.427 0.691 . . . . 0.0 111.486 179.738 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 4.8 p -83.42 144.01 10.85 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.706 0 C-N-CA 124.49 1.116 . . . . 0.0 109.558 168.342 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 58.6 p -131.53 145.19 51.62 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 124.823 1.249 . . . . 0.0 110.692 178.82 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -68.7 138.01 31.21 Favored Glycine 0 CA--C 1.529 0.922 0 C-N-CA 124.327 0.965 . . . . 0.0 112.152 178.958 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 83.9 t -127.26 140.95 47.65 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.595 0 C-N-CA 124.583 1.153 . . . . 0.0 111.213 -176.586 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 65.9 t80 -64.91 124.2 21.42 Favored 'General case' 0 CA--C 1.545 0.784 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 -174.051 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 65.1 t0 -87.54 99.11 11.79 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 126.57 1.948 . . . . 0.0 109.803 172.269 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 -64.65 -24.45 67.59 Favored 'General case' 0 N--CA 1.473 0.712 0 N-CA-C 114.402 1.26 . . . . 0.0 114.402 -174.745 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 35.5 tp10 -75.34 -53.36 8.87 Favored 'General case' 0 N--CA 1.471 0.598 0 O-C-N 121.383 -0.823 . . . . 0.0 112.395 -179.187 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 65.2 m -87.74 -21.47 25.15 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 124.276 1.03 . . . . 0.0 113.189 179.5 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 79.91 30.35 43.42 Favored Glycine 0 CA--C 1.533 1.166 0 C-N-CA 124.712 1.149 . . . . 0.0 112.992 -175.382 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 79.2 mm-40 -111.33 -167.46 1.18 Allowed 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 125.861 1.664 . . . . 0.0 110.87 -177.5 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 73.3 m95 -125.41 145.89 49.86 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 125.399 1.48 . . . . 0.0 110.022 171.981 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 16.4 m -139.41 143.71 30.45 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.057 0 C-N-CA 124.838 1.255 . . . . 0.0 113.12 -172.135 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 12.3 m0 -94.35 102.05 14.03 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 126.036 1.735 . . . . 0.0 108.999 170.463 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 53.5 mtmt -74.14 151.13 40.13 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 125.828 1.651 . . . . 0.0 112.61 -177.275 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 54.3 t30 49.89 38.28 15.65 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 125.443 1.497 . . . . 0.0 112.825 -176.134 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 97.2 m -118.66 140.53 49.77 Favored 'General case' 0 N--CA 1.48 1.07 0 O-C-N 121.136 -0.978 . . . . 0.0 112.942 -172.212 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 14.0 tt -132.45 145.49 34.45 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.534 0 C-N-CA 127.729 2.412 . . . . 0.0 110.12 177.737 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 78.7 tt0 -108.86 131.99 54.46 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 124.861 1.264 . . . . 0.0 110.776 170.198 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 7.1 p -152.66 140.32 13.61 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 C-N-CA 124.786 1.235 . . . . 0.0 110.707 176.51 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 60.2 t30 53.4 37.68 26.1 Favored 'General case' 0 CA--C 1.553 1.084 0 C-N-CA 124.695 1.198 . . . . 0.0 113.21 179.268 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 73.35 10.2 78.49 Favored Glycine 0 CA--C 1.545 1.919 0 C-N-CA 124.828 1.204 . . . . 0.0 115.605 -179.678 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 55.4 mtmt -130.96 154.11 48.48 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 125.767 1.627 . . . . 0.0 111.979 -176.313 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 68.8 m-85 -92.91 149.56 21.17 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-O 121.949 0.88 . . . . 0.0 113.18 176.211 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -149.08 165.29 32.16 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 126.873 2.069 . . . . 0.0 109.489 -179.622 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 596' ' ' HIS . . . . . . . . . . . . . 26.1 m80 -83.52 141.49 31.59 Favored 'General case' 0 N--CA 1.467 0.388 0 O-C-N 121.68 -0.638 . . . . 0.0 109.58 168.424 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 15.3 m -64.93 -43.06 94.0 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 112.251 0.463 . . . . 0.0 112.251 -177.137 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 40.4 p -67.91 -41.75 82.19 Favored 'General case' 0 N--CA 1.481 1.104 0 N-CA-C 112.953 0.724 . . . . 0.0 112.953 175.769 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 599' ' ' CYS . . . . . . . . . . . . . 89.1 m -56.56 -54.37 46.69 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.489 1.116 . . . . 0.0 110.999 173.347 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 71.5 t80 -57.26 -45.06 84.36 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.166 0.987 . . . . 0.0 111.972 177.144 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 86.5 t60 -62.25 -42.53 99.4 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 114.071 1.137 . . . . 0.0 114.071 -179.194 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 75.1 mm-40 -80.21 -30.87 38.71 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 113.93 1.085 . . . . 0.0 113.93 177.186 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 86.6 m . . . . . 0 N--CA 1.484 1.253 0 N-CA-C 113.357 0.873 . . . . 0.0 113.357 -171.842 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 31.4 mm . . . . . 0 N--CA 1.47 0.56 0 CA-C-O 120.371 0.129 . . . . 0.0 111.022 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -69.93 -28.5 65.63 Favored 'General case' 0 N--CA 1.481 1.083 0 O-C-N 121.459 -0.775 . . . . 0.0 112.444 174.58 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -76.45 -9.08 86.08 Favored Glycine 0 CA--C 1.539 1.536 0 C-N-CA 125.435 1.493 . . . . 0.0 115.042 176.623 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 9.7 mmpt? -67.19 141.41 57.33 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-N 119.477 1.639 . . . . 0.0 111.14 172.349 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 51.5 p90 -153.79 164.83 37.68 Favored 'General case' 0 C--O 1.24 0.563 0 C-N-CA 124.354 1.062 . . . . 0.0 112.27 170.854 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 6.5 m -129.74 137.15 57.43 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 C-N-CA 126.19 1.796 . . . . 0.0 108.971 169.493 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 9.2 p -66.49 134.84 29.46 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.923 0 O-C-N 121.167 -0.958 . . . . 0.0 110.043 -179.312 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 3.3 t -88.09 114.55 59.82 Favored Pre-proline 0 CA--C 1.54 0.567 0 C-N-CA 123.68 0.792 . . . . 0.0 109.112 174.564 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 95.5 Cg_endo -74.29 162.97 37.45 Favored 'Trans proline' 0 CA--C 1.534 0.503 0 C-N-CA 122.704 2.269 . . . . 0.0 112.937 -178.826 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 17.1 pt-20 -66.0 -19.56 65.9 Favored 'General case' 0 N--CA 1.477 0.904 0 O-C-N 121.318 -0.864 . . . . 0.0 113.022 172.148 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 76.7 p -80.91 -6.07 58.22 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 126.057 1.743 . . . . 0.0 113.685 172.103 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 44.1 t -60.28 148.02 38.19 Favored 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 114.333 1.234 . . . . 0.0 114.333 -179.168 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 7.2 pt20 -74.32 88.05 2.03 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.953 1.301 . . . . 0.0 111.577 170.955 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 26.6 m-20 56.33 19.28 3.88 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 126.479 1.912 . . . . 0.0 115.175 176.313 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 10.5 mtt 55.75 30.98 16.63 Favored 'General case' 0 N--CA 1.472 0.625 0 N-CA-C 115.259 1.577 . . . . 0.0 115.259 -174.217 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -133.92 139.28 46.04 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.304 1.042 . . . . 0.0 112.637 -178.713 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 5.7 t80 -154.31 159.49 41.25 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 123.361 0.665 . . . . 0.0 112.107 177.74 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -88.88 152.44 21.74 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 125.465 1.506 . . . . 0.0 114.106 -172.74 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 25.3 t -104.16 104.41 43.76 Favored Pre-proline 0 CA--C 1.547 0.863 0 C-N-CA 126.615 1.966 . . . . 0.0 109.347 166.117 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -62.16 -23.49 75.53 Favored 'Trans proline' 0 CA--C 1.54 0.803 0 C-N-CA 123.243 2.629 . . . . 0.0 115.258 178.314 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 79.0 mt -72.96 -54.52 15.59 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 C-N-CA 124.089 0.956 . . . . 0.0 111.044 -176.749 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 14.1 p -102.8 1.19 33.84 Favored 'General case' 0 CA--C 1.551 1.014 0 N-CA-C 113.807 1.04 . . . . 0.0 113.807 -178.409 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 568' ' ' LYS . . . . . . . . . . . . 0.304 0.0 OUTLIER 55.73 43.71 27.45 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 127.808 2.443 . . . . 0.0 113.688 -175.909 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 70.9 mm-40 -110.88 -177.58 3.25 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.096 0.558 . . . . 0.0 112.41 179.568 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 99.1 m -125.9 126.72 44.87 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 124.817 1.247 . . . . 0.0 111.346 177.793 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 1.2 m -87.61 144.7 8.69 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.775 0 C-N-CA 124.645 1.178 . . . . 0.0 110.61 168.681 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 51.4 p -130.63 144.1 51.19 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 124.42 1.088 . . . . 0.0 111.296 176.438 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -67.54 152.81 52.8 Favored Glycine 0 CA--C 1.535 1.294 0 C-N-CA 124.201 0.905 . . . . 0.0 113.845 179.715 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 8.9 p -137.6 142.08 37.53 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 C-N-CA 125.177 1.391 . . . . 0.0 112.14 176.345 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 75.6 t80 -77.21 123.11 25.99 Favored 'General case' 0 CA--C 1.542 0.667 0 O-C-N 120.618 -1.301 . . . . 0.0 112.984 -173.214 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 24.3 t0 -90.08 118.14 29.39 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 124.67 1.188 . . . . 0.0 111.427 169.217 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 63.2 mt-10 -71.84 -27.75 63.1 Favored 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 113.656 0.984 . . . . 0.0 113.656 -178.788 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -75.31 -50.27 16.56 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 123.797 0.839 . . . . 0.0 111.998 -178.398 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 13.0 t -74.18 -28.98 61.54 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.461 0.705 . . . . 0.0 112.268 171.933 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 76.57 29.35 58.0 Favored Glycine 0 CA--C 1.536 1.39 0 C-N-CA 123.651 0.643 . . . . 0.0 112.721 -174.905 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 79.4 mm-40 -141.65 157.48 45.03 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 125.454 1.501 . . . . 0.0 111.106 -173.154 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 75.7 m95 -79.63 146.62 32.41 Favored 'General case' 0 N--CA 1.47 0.554 0 O-C-N 121.157 -0.964 . . . . 0.0 112.007 177.359 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 8.5 m -135.05 138.89 48.22 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 C-N-CA 126.249 1.82 . . . . 0.0 112.433 -177.068 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 0.8 OUTLIER -90.4 100.21 13.09 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 126.062 1.745 . . . . 0.0 107.23 170.229 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 42.7 mtmt -75.48 150.32 38.25 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 123.861 0.864 . . . . 0.0 112.367 179.088 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 54.1 t30 51.45 40.23 26.26 Favored 'General case' 0 CA--C 1.551 1.01 0 C-N-CA 125.627 1.571 . . . . 0.0 112.43 -174.666 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 80.6 m -125.21 145.88 49.77 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 124.149 0.98 . . . . 0.0 112.895 -174.584 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 8.4 tt -142.81 148.16 20.0 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 C-N-CA 127.577 2.351 . . . . 0.0 110.743 -178.825 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 60.4 tt0 -110.38 126.15 53.97 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 125.24 1.416 . . . . 0.0 109.539 169.683 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 2.2 t -142.99 129.57 17.61 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 C-N-CA 126.322 1.849 . . . . 0.0 109.809 -177.041 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 70.1 m-20 52.78 37.09 22.97 Favored 'General case' 0 CA--C 1.551 1.01 0 C-N-CA 125.064 1.346 . . . . 0.0 114.073 174.39 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 79.59 8.21 87.91 Favored Glycine 0 CA--C 1.536 1.397 0 C-N-CA 124.853 1.216 . . . . 0.0 115.485 -179.557 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 56.6 mtmt -127.54 155.46 43.76 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 125.878 1.671 . . . . 0.0 111.408 178.029 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 65.6 m-85 -98.87 149.45 22.9 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 123.905 0.882 . . . . 0.0 112.424 175.996 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 93.5 m-85 -150.58 162.04 41.42 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 126.087 1.755 . . . . 0.0 111.547 -174.924 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 596' ' ' HIS . . . . . 0.402 ' HB2' ' HB2' ' A' ' 599' ' ' CYS . 18.3 m80 -74.69 141.01 44.57 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 166.935 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 9.2 t -65.09 -40.36 94.49 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 118.219 0.463 . . . . 0.0 111.504 177.471 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 21.4 p -60.67 -45.32 94.59 Favored 'General case' 0 N--CA 1.478 0.938 0 N-CA-C 114.062 1.134 . . . . 0.0 114.062 172.001 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 599' ' ' CYS . . . . . 0.402 ' HB2' ' HB2' ' A' ' 596' ' ' HIS . 98.9 m -62.13 -51.52 67.56 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 123.884 0.874 . . . . 0.0 111.837 177.551 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 68.5 t80 -61.27 -41.97 97.85 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 123.599 0.759 . . . . 0.0 112.012 177.659 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 23.8 t-80 -68.01 -35.14 77.79 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 123.886 0.875 . . . . 0.0 113.263 178.238 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 31.8 tp10 -69.8 -34.21 73.41 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 124.514 1.125 . . . . 0.0 112.384 172.161 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 95.8 m . . . . . 0 N--CA 1.48 1.037 0 C-N-CA 124.122 0.969 . . . . 0.0 111.765 173.513 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 33.2 mm . . . . . 0 N--CA 1.477 0.881 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 547' ' ' ARG . . . . . 0.423 ' H ' ' HD2' ' A' ' 547' ' ' ARG . 0.0 OUTLIER -87.16 -8.99 56.36 Favored 'General case' 0 N--CA 1.48 1.038 0 N-CA-C 113.883 1.068 . . . . 0.0 113.883 177.988 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -77.69 -12.58 84.34 Favored Glycine 0 CA--C 1.537 1.447 0 C-N-CA 124.677 1.132 . . . . 0.0 114.523 170.301 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -69.75 135.33 49.62 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 118.769 1.284 . . . . 0.0 113.003 -178.462 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 42.7 p90 -154.74 162.82 40.97 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 124.737 1.215 . . . . 0.0 112.538 169.979 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -136.07 133.03 50.43 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.581 0 C-N-CA 126.246 1.819 . . . . 0.0 109.925 179.84 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 9.9 p -67.37 138.94 21.8 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.135 0 C-N-CA 123.633 0.773 . . . . 0.0 111.64 -175.868 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 61.6 t -76.24 115.74 49.77 Favored Pre-proline 0 N--CA 1.473 0.681 0 C-N-CA 124.53 1.132 . . . . 0.0 108.752 169.835 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -79.49 157.72 25.43 Favored 'Trans proline' 0 CA--C 1.54 0.791 0 C-N-CA 122.965 2.443 . . . . 0.0 111.972 176.914 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -64.63 -24.36 67.56 Favored 'General case' 0 CA--C 1.55 0.97 0 N-CA-C 113.414 0.894 . . . . 0.0 113.414 179.897 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 37.4 p -69.04 -37.36 78.55 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 125.557 1.543 . . . . 0.0 112.453 174.399 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 60.9 m -79.85 59.88 3.29 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.001 1.321 . . . . 0.0 111.046 171.267 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -65.7 -17.15 64.4 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 124.928 1.291 . . . . 0.0 114.131 -170.276 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 70.2 m-20 -73.85 -17.93 61.0 Favored 'General case' 0 N--CA 1.479 1.011 0 O-C-N 120.902 -1.124 . . . . 0.0 113.142 169.59 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 37.9 mtp 57.29 25.27 10.94 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 127.479 2.311 . . . . 0.0 115.102 176.886 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -140.96 152.82 45.28 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 124.319 1.048 . . . . 0.0 113.34 -175.073 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -156.1 160.66 40.14 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 126.45 1.9 . . . . 0.0 110.009 175.736 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 77.6 tttt -100.77 151.63 21.45 Favored 'General case' 0 N--CA 1.48 1.069 0 O-C-N 121.07 -1.019 . . . . 0.0 112.942 -179.455 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 49.0 t -92.22 110.27 43.33 Favored Pre-proline 0 CA--C 1.545 0.765 0 C-N-CA 127.374 2.27 . . . . 0.0 109.431 169.249 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -62.37 -15.37 44.63 Favored 'Trans proline' 0 CA--C 1.541 0.833 0 C-N-CA 123.919 3.08 . . . . 0.0 116.052 175.81 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 96.8 mt -80.05 -62.18 1.49 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.893 0 CA-C-N 119.311 0.959 . . . . 0.0 110.779 -179.239 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 14.7 p -96.96 -0.22 47.81 Favored 'General case' 0 CA--C 1.544 0.75 0 N-CA-C 113.947 1.092 . . . . 0.0 113.947 -177.521 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 568' ' ' LYS . . . . . . . . . . . . . 11.0 mptt 60.83 46.03 9.19 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 127.626 2.371 . . . . 0.0 111.707 -179.773 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 65.9 mm-40 -124.05 142.1 51.47 Favored 'General case' 0 N--CA 1.484 1.257 0 N-CA-C 114.947 1.462 . . . . 0.0 114.947 -175.085 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 88.4 m -87.71 122.41 31.35 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.794 0.838 . . . . 0.0 112.714 -177.42 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 2.9 m -81.98 151.13 4.27 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 C-N-CA 124.554 1.142 . . . . 0.0 110.007 167.243 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 57.6 p -131.96 147.97 52.49 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 124.728 1.211 . . . . 0.0 110.766 173.64 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -64.62 144.04 47.76 Favored Glycine 0 N--CA 1.468 0.825 0 C-N-CA 124.041 0.829 . . . . 0.0 113.775 -179.564 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 67.7 t -135.38 128.46 48.31 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.446 0 C-N-CA 125.575 1.55 . . . . 0.0 111.248 -179.52 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 88.3 t80 -67.59 115.72 7.5 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 121.687 -0.633 . . . . 0.0 112.278 -178.803 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -82.2 121.13 26.23 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 124.126 0.971 . . . . 0.0 110.234 169.888 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 53.0 mt-10 -70.72 -36.27 73.12 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.715 1.206 . . . . 0.0 113.841 -169.572 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -88.92 -33.93 17.1 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 119.041 0.837 . . . . 0.0 113.159 -178.586 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 19.3 m -72.24 -30.58 65.02 Favored 'General case' 0 N--CA 1.476 0.858 0 CA-C-N 118.421 0.555 . . . . 0.0 111.512 169.793 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 75.14 28.73 61.65 Favored Glycine 0 CA--C 1.535 1.289 0 C-N-CA 125.539 1.543 . . . . 0.0 113.562 -177.3 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 75.0 mm-40 -144.89 148.15 33.58 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 124.394 1.078 . . . . 0.0 112.246 -169.814 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 83.8 m95 -75.35 134.65 40.94 Favored 'General case' 0 C--N 1.327 -0.408 0 O-C-N 121.187 -0.946 . . . . 0.0 110.996 177.91 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 17.6 m -137.11 152.25 27.92 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 C-N-CA 126.359 1.864 . . . . 0.0 112.112 -173.704 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 5.8 m0 -93.96 102.64 14.74 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 126.011 1.724 . . . . 0.0 108.171 170.781 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 72.9 mmtt -78.12 145.44 35.73 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 124.408 1.083 . . . . 0.0 111.944 -178.431 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 60.08 37.64 20.93 Favored 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 125.097 1.359 . . . . 0.0 111.602 -175.691 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 26.8 m -128.7 149.02 50.86 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 124.783 1.233 . . . . 0.0 112.285 -171.222 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 17.3 tt -135.48 144.86 32.78 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 C-N-CA 127.507 2.323 . . . . 0.0 110.208 178.151 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 71.9 tt0 -106.15 125.63 51.23 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.478 1.111 . . . . 0.0 109.783 169.232 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 7.7 p -152.4 134.45 5.9 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.712 0 C-N-CA 124.589 1.155 . . . . 0.0 111.318 -175.826 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 70.9 m-20 53.27 35.29 19.73 Favored 'General case' 0 CA--C 1.553 1.093 0 C-N-CA 124.875 1.27 . . . . 0.0 114.266 -178.648 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 79.99 6.88 88.95 Favored Glycine 0 CA--C 1.538 1.529 0 C-N-CA 124.947 1.261 . . . . 0.0 115.64 179.727 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -130.43 158.39 40.03 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 125.388 1.475 . . . . 0.0 112.363 -179.383 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 78.3 m-85 -92.62 149.48 21.31 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-O 122.049 0.928 . . . . 0.0 113.02 176.222 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 77.2 m-85 -152.12 159.98 43.52 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 126.371 1.868 . . . . 0.0 109.746 -176.43 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 596' ' ' HIS . . . . . 0.426 ' HB2' ' HB2' ' A' ' 599' ' ' CYS . 28.8 m80 -76.76 140.2 40.69 Favored 'General case' 0 N--CA 1.473 0.694 0 O-C-N 120.915 -1.116 . . . . 0.0 108.369 167.82 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 53.1 p -63.76 -40.17 96.05 Favored 'General case' 0 N--CA 1.469 0.513 0 O-C-N 121.732 -0.605 . . . . 0.0 112.254 -177.74 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 7.2 p -69.39 -42.28 75.34 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 124.743 1.217 . . . . 0.0 113.157 174.844 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 599' ' ' CYS . . . . . 0.426 ' HB2' ' HB2' ' A' ' 596' ' ' HIS . 77.4 m -57.45 -54.95 41.05 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.304 1.042 . . . . 0.0 110.896 174.052 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 61.9 t80 -55.49 -49.01 73.66 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 124.09 0.956 . . . . 0.0 111.889 178.44 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 86.3 t60 -63.21 -40.32 97.15 Favored 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 113.114 0.783 . . . . 0.0 113.114 -178.795 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -71.45 -37.89 71.37 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 123.855 0.862 . . . . 0.0 112.657 176.83 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 91.6 m . . . . . 0 N--CA 1.476 0.857 0 C-N-CA 124.321 1.048 . . . . 0.0 113.549 -171.651 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 533' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.436 0 N-CA-C 111.551 -0.62 . . . . 0.0 111.551 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . -67.18 150.16 51.62 Favored Glycine 0 CA--C 1.537 1.408 0 CA-C-N 118.076 0.938 . . . . 0.0 113.416 175.799 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 535' ' ' SER . . . . . . . . . . . . . 61.0 p -70.16 -46.12 65.34 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 124.443 1.097 . . . . 0.0 112.332 178.825 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 536' ' ' GLU . . . . . . . . . . . . . 64.1 mt-10 -135.83 -21.88 1.45 Allowed 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 125.763 1.625 . . . . 0.0 113.56 175.84 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 537' ' ' PHE . . . . . . . . . . . . . 87.4 m-85 -70.82 142.7 51.27 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 124.023 0.929 . . . . 0.0 111.549 173.215 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 47.1 t -79.75 134.52 36.38 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 123.188 0.595 . . . . 0.0 111.594 171.026 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 539' ' ' ASP . . . . . . . . . . . . . 76.8 m-20 -87.71 0.25 55.97 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 124.659 1.183 . . . . 0.0 113.264 174.856 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 540' ' ' ARG . . . . . . . . . . . . . 76.8 mtp85 -77.98 31.17 0.17 Allowed 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 126.291 1.836 . . . . 0.0 114.646 -174.267 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 8.2 t 62.27 172.08 0.13 Allowed 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 127.766 2.426 . . . . 0.0 115.335 -177.97 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 542' ' ' ASN . . . . . . . . . . . . . 40.4 t30 -69.57 -12.63 61.8 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.754 1.622 . . . . 0.0 113.869 179.604 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 44.9 tp10 -54.58 -40.21 68.56 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 124.846 1.258 . . . . 0.0 113.106 -178.435 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 72.1 mt -77.46 -30.95 53.46 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 123.984 0.914 . . . . 0.0 112.866 176.752 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 37.9 tp10 -69.84 -30.48 67.98 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 124.313 1.045 . . . . 0.0 113.202 -174.808 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 18.0 mm -61.53 -43.01 96.18 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 123.552 0.741 . . . . 0.0 110.914 171.647 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 8.1 tmm_? -76.49 -23.83 53.79 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.919 1.288 . . . . 0.0 112.815 -177.243 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -71.45 -12.04 72.72 Favored Glycine 0 CA--C 1.541 1.689 0 C-N-CA 124.721 1.153 . . . . 0.0 115.579 175.941 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 71.8 mmtt -68.23 152.54 45.31 Favored 'General case' 0 N--CA 1.476 0.864 0 CA-C-N 119.108 1.454 . . . . 0.0 112.79 178.787 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 51.1 p90 -154.82 166.12 34.47 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 124.867 1.267 . . . . 0.0 112.629 172.796 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 1.6 m -135.35 140.2 45.32 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.885 0 C-N-CA 126.326 1.851 . . . . 0.0 110.294 175.767 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 78.8 t -69.07 130.9 34.22 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.232 0 O-C-N 121.297 -0.877 . . . . 0.0 111.278 -177.462 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 553' ' ' VAL . . . . . 0.458 HG22 ' CD2' ' A' ' 584' ' ' TRP . 11.2 t -79.26 122.44 84.16 Favored Pre-proline 0 CA--C 1.541 0.602 0 C-N-CA 124.183 0.993 . . . . 0.0 110.01 172.286 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -75.8 156.39 39.46 Favored 'Trans proline' 0 CA--C 1.537 0.663 0 C-N-CA 122.56 2.173 . . . . 0.0 112.251 176.484 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 15.7 pm0 -66.43 -17.25 64.68 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 124.295 1.038 . . . . 0.0 113.493 174.205 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 74.2 p -81.34 -9.28 59.78 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 125.891 1.677 . . . . 0.0 113.06 172.726 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 43.9 t -59.79 141.15 55.84 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 119.293 0.951 . . . . 0.0 113.225 179.451 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 88.3 mm-40 -75.11 97.13 3.38 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 124.115 0.966 . . . . 0.0 110.132 173.02 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 30.0 m-20 55.25 25.62 7.57 Favored 'General case' 0 CA--C 1.554 1.107 0 C-N-CA 126.288 1.835 . . . . 0.0 114.808 177.937 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 8.1 mtt 57.32 32.99 22.65 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 125.6 1.56 . . . . 0.0 114.707 179.391 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -137.8 149.4 46.34 Favored 'General case' 0 CA--C 1.538 0.489 0 N-CA-C 115.058 1.503 . . . . 0.0 115.058 -173.39 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 24.5 m-85 -149.25 165.68 31.19 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 127.34 2.256 . . . . 0.0 110.014 171.322 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 19.7 ttmm -117.95 133.9 55.47 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 123.928 0.891 . . . . 0.0 112.317 -179.092 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 14.4 t -73.59 111.73 13.26 Favored Pre-proline 0 CA--C 1.547 0.856 0 C-N-CA 127.045 2.138 . . . . 0.0 110.483 170.487 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 79.9 Cg_endo -70.64 -15.41 33.79 Favored 'Trans proline' 0 CA--C 1.542 0.913 0 C-N-CA 122.728 2.285 . . . . 0.0 114.132 175.936 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 93.0 mt -73.7 -56.12 10.33 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.823 0 C-N-CA 124.307 1.043 . . . . 0.0 110.924 -178.866 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 13.8 p -102.38 -1.68 30.36 Favored 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 124.752 1.221 . . . . 0.0 113.901 -179.816 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 568' ' ' LYS . . . . . . . . . . . . . 33.1 mmtp 62.65 41.67 9.08 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 127.072 2.149 . . . . 0.0 113.462 -178.173 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 75.0 mm-40 -122.76 145.62 48.25 Favored 'General case' 0 N--CA 1.482 1.175 0 N-CA-C 113.841 1.052 . . . . 0.0 113.841 -174.251 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 28.0 m -94.16 121.06 35.28 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.661 0.784 . . . . 0.0 111.463 -173.798 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 4.8 m -80.2 148.65 5.6 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.675 0 C-N-CA 124.62 1.168 . . . . 0.0 111.358 168.943 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 45.5 p -132.69 144.46 50.32 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 124.93 1.292 . . . . 0.0 111.193 174.843 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -67.31 152.17 52.59 Favored Glycine 0 CA--C 1.539 1.563 0 C-N-CA 124.419 1.009 . . . . 0.0 113.94 176.978 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 46.3 t -133.19 137.74 52.83 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.956 0 C-N-CA 125.937 1.695 . . . . 0.0 111.108 178.591 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 33.3 t80 -69.95 140.92 53.09 Favored 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 114.51 1.3 . . . . 0.0 114.51 -173.898 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 40.1 t0 -114.33 108.5 17.0 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 127.341 2.257 . . . . 0.0 110.469 170.858 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -66.23 -27.5 68.02 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 114.317 1.229 . . . . 0.0 114.317 -179.461 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -74.92 -50.76 15.73 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-N 118.994 0.815 . . . . 0.0 112.09 -176.79 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 25.3 t -77.52 -31.95 53.76 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 123.452 0.701 . . . . 0.0 111.704 174.255 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 81.92 29.53 38.07 Favored Glycine 0 CA--C 1.53 1.012 0 C-N-CA 124.011 0.815 . . . . 0.0 112.201 -173.991 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 80.0 mm-40 -129.61 -174.08 3.2 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 126.529 1.932 . . . . 0.0 110.156 -176.422 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 53.8 m95 -117.99 156.63 28.21 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.458 1.103 . . . . 0.0 110.986 178.815 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 17.7 m -137.62 140.36 41.57 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 C-N-CA 125.505 1.522 . . . . 0.0 112.816 -177.473 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 584' ' ' TRP . . . . . 0.458 ' CD2' HG22 ' A' ' 553' ' ' VAL . 1.1 m0 -90.95 105.6 17.94 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 126.575 1.95 . . . . 0.0 108.682 173.697 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 30.8 mmmt -72.27 142.52 48.91 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 125.144 1.378 . . . . 0.0 111.239 -177.91 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 57.9 t30 51.2 39.45 23.7 Favored 'General case' 0 CA--C 1.553 1.078 0 C-N-CA 125.633 1.573 . . . . 0.0 113.496 -177.247 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 89.7 m -124.01 149.63 45.8 Favored 'General case' 0 N--CA 1.482 1.129 0 O-C-N 120.629 -1.295 . . . . 0.0 112.966 -170.931 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 10.4 tt -141.51 137.27 32.4 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.636 0 C-N-CA 127.326 2.25 . . . . 0.0 110.638 178.909 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 77.5 tt0 -107.19 137.18 45.74 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 125.295 1.438 . . . . 0.0 109.664 169.715 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 7.6 p -151.71 123.29 1.06 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 C-N-CA 124.789 1.236 . . . . 0.0 110.847 179.084 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 35.3 m120 49.09 41.31 19.21 Favored 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 125.914 1.685 . . . . 0.0 114.11 174.433 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 85.97 1.41 86.85 Favored Glycine 0 CA--C 1.536 1.378 0 N-CA-C 116.071 1.189 . . . . 0.0 116.071 179.48 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -114.42 153.09 30.51 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 125.662 1.585 . . . . 0.0 111.984 177.469 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 42.0 m-85 -112.35 145.04 40.78 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 125.237 1.415 . . . . 0.0 111.937 177.8 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 99.1 m-85 -152.41 164.84 36.72 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 125.161 1.384 . . . . 0.0 111.541 -176.795 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 596' ' ' HIS . . . . . 0.426 ' HB2' ' HB2' ' A' ' 599' ' ' CYS . 21.4 m80 -78.15 144.51 36.35 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 166.501 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 19.5 t -64.16 -44.99 90.41 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 118.419 0.554 . . . . 0.0 111.365 178.29 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 22.8 p -64.09 -34.98 79.28 Favored 'General case' 0 N--CA 1.479 1.004 0 N-CA-C 114.016 1.117 . . . . 0.0 114.016 175.358 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 599' ' ' CYS . . . . . 0.426 ' HB2' ' HB2' ' A' ' 596' ' ' HIS . 87.9 m -71.53 -54.74 9.53 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 123.84 0.856 . . . . 0.0 111.22 176.226 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 70.7 t80 -61.04 -34.99 75.73 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 123.587 0.755 . . . . 0.0 112.606 -178.996 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 82.7 t60 -55.7 -31.88 62.83 Favored 'General case' 0 CA--C 1.543 0.688 0 O-C-N 121.167 -0.958 . . . . 0.0 113.554 176.394 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -73.27 -25.2 60.59 Favored 'General case' 0 CA--C 1.548 0.888 0 O-C-N 121.203 -0.935 . . . . 0.0 113.387 174.532 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 44.0 p -106.64 0.35 24.32 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 125.384 1.474 . . . . 0.0 114.429 -175.439 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 604' ' ' SER . . . . . . . . . . . . . 49.6 m -65.04 88.35 0.07 Allowed 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 125.503 1.521 . . . . 0.0 113.695 -179.83 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 605' ' ' GLN . . . . . . . . . . . . . 91.2 mt-30 -64.81 118.27 8.74 Favored 'General case' 0 CA--C 1.54 0.594 0 O-C-N 120.978 -1.077 . . . . 0.0 110.609 171.137 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 606' ' ' ASN . . . . . . . . . . . . . 5.2 p30 -154.25 148.84 26.34 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.325 1.05 . . . . 0.0 112.142 -177.376 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 607' ' ' SER . . . . . . . . . . . . . 72.2 p -165.31 -42.96 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 125.307 1.443 . . . . 0.0 112.039 174.204 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 608' ' ' SER . . . . . . . . . . . . . 51.6 p . . . . . 0 C--O 1.253 1.284 0 C-N-CA 126.447 1.899 . . . . 0.0 113.824 173.581 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 533' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.577 0 N-CA-C 111.896 -0.481 . . . . 0.0 111.896 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . -68.71 150.2 50.35 Favored Glycine 0 CA--C 1.537 1.424 0 C-N-CA 123.814 0.721 . . . . 0.0 113.631 178.882 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 535' ' ' SER . . . . . . . . . . . . . 78.4 p -70.65 -24.13 62.65 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.574 1.149 . . . . 0.0 113.683 178.878 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 536' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -141.28 94.07 2.65 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 125.953 1.701 . . . . 0.0 108.877 173.872 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 537' ' ' PHE . . . . . . . . . . . . . 52.7 t80 -153.91 -178.06 6.82 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 125.58 1.552 . . . . 0.0 111.423 -169.37 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 36.9 m -56.27 160.43 3.01 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 125.631 1.572 . . . . 0.0 113.688 174.25 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 539' ' ' ASP . . . . . . . . . . . . . 66.9 m-20 -73.03 69.58 1.0 Allowed 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 125.887 1.675 . . . . 0.0 113.825 -174.232 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 540' ' ' ARG . . . . . . . . . . . . . 27.7 mmm180 -73.08 63.04 0.66 Allowed 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 126.576 1.95 . . . . 0.0 112.349 175.148 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 43.8 t -64.39 152.4 41.5 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 125.46 1.504 . . . . 0.0 112.77 177.455 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 542' ' ' ASN . . . . . . . . . . . . . 77.6 m-20 -57.57 -26.36 61.35 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 124.016 0.926 . . . . 0.0 112.427 170.471 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 47.4 tp10 -54.97 -38.09 67.34 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 125.01 1.324 . . . . 0.0 111.892 173.432 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 37.2 mt -73.4 -36.39 66.0 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 123.501 0.72 . . . . 0.0 112.256 179.018 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -71.15 -33.53 70.13 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 123.864 0.865 . . . . 0.0 113.052 -179.049 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 12.0 mm -67.09 -35.83 75.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 122.963 0.505 . . . . 0.0 110.736 171.255 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 95.6 mtt-85 -77.84 -25.88 49.04 Favored 'General case' 0 N--CA 1.48 1.049 0 O-C-N 121.027 -1.046 . . . . 0.0 113.399 178.381 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -69.59 -9.01 61.08 Favored Glycine 0 CA--C 1.537 1.417 0 C-N-CA 125.537 1.541 . . . . 0.0 115.087 176.026 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -63.04 149.82 44.07 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-N 118.513 1.156 . . . . 0.0 111.714 170.744 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 45.6 p90 -156.44 166.61 32.93 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.205 1.002 . . . . 0.0 112.373 176.039 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 12.0 m -129.7 140.32 49.35 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 C-N-CA 126.299 1.84 . . . . 0.0 109.258 169.448 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 48.4 t -71.45 128.58 34.72 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.106 0 O-C-N 121.16 -0.963 . . . . 0.0 110.006 -177.225 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 553' ' ' VAL . . . . . 0.479 HG22 ' CD2' ' A' ' 584' ' ' TRP . 4.0 t -79.72 126.37 80.51 Favored Pre-proline 0 CA--C 1.538 0.498 0 C-N-CA 123.78 0.832 . . . . 0.0 109.001 171.169 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -66.82 145.15 73.9 Favored 'Trans proline' 0 CA--C 1.538 0.698 0 C-N-CA 122.734 2.289 . . . . 0.0 112.248 -177.975 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 17.1 pt-20 -63.14 -17.13 62.01 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 113.49 0.922 . . . . 0.0 113.49 175.991 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 10.7 m -66.08 -30.86 71.45 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 125.436 1.494 . . . . 0.0 112.002 171.729 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 28.7 t -81.01 130.84 35.2 Favored 'General case' 0 N--CA 1.472 0.643 0 O-C-N 121.632 -0.668 . . . . 0.0 111.684 174.062 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 2.6 pm0 -101.8 -25.8 13.69 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.692 1.597 . . . . 0.0 112.203 169.08 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 87.3 m-20 -77.41 -38.08 50.52 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 124.456 1.103 . . . . 0.0 112.924 179.781 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 8.7 mtt 51.46 36.01 15.69 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.694 1.597 . . . . 0.0 115.131 175.284 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -131.74 146.55 52.22 Favored 'General case' 0 CA--C 1.54 0.558 0 N-CA-C 114.057 1.132 . . . . 0.0 114.057 -173.95 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 2.8 t80 -153.98 179.66 8.7 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 125.749 1.62 . . . . 0.0 110.38 173.57 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 22.9 ttmm -135.05 138.16 43.62 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 124.434 1.094 . . . . 0.0 113.038 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 26.4 t -71.62 116.75 50.94 Favored Pre-proline 0 CA--C 1.539 0.544 0 C-N-CA 126.301 1.84 . . . . 0.0 110.198 170.271 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo -72.65 -17.68 26.04 Favored 'Trans proline' 0 CA--C 1.543 0.951 0 C-N-CA 122.859 2.373 . . . . 0.0 113.581 176.3 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 90.7 mt -73.02 -55.35 13.09 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 CA-C-N 119.803 1.183 . . . . 0.0 110.953 -178.547 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 14.9 p -103.35 2.76 34.44 Favored 'General case' 0 CA--C 1.553 1.062 0 C-N-CA 124.566 1.146 . . . . 0.0 113.494 -179.242 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 568' ' ' LYS . . . . . . . . . . . . 0.335 64.1 pttt 56.0 42.92 28.01 Favored 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 127.083 2.153 . . . . 0.0 113.608 -177.63 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 69.8 mm-40 -119.6 137.81 53.63 Favored 'General case' 0 N--CA 1.483 1.207 0 N-CA-C 114.803 1.409 . . . . 0.0 114.803 -174.666 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 49.9 m -74.37 140.55 44.86 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 124.679 1.192 . . . . 0.0 112.992 -178.214 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -114.84 145.51 20.5 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.617 0 C-N-CA 126.576 1.95 . . . . 0.0 110.86 168.948 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 44.6 p -133.31 141.53 48.01 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.601 1.16 . . . . 0.0 111.794 178.752 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -70.6 147.32 43.47 Favored Glycine 0 CA--C 1.534 1.236 0 C-N-CA 124.709 1.147 . . . . 0.0 113.615 -179.637 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 71.8 t -130.03 141.98 44.98 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 C-N-CA 125.318 1.447 . . . . 0.0 111.139 -179.737 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 62.0 t80 -65.41 131.33 46.16 Favored 'General case' 0 CA--C 1.544 0.742 0 CA-C-O 121.828 0.823 . . . . 0.0 112.725 -175.931 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 49.9 t0 -96.03 99.39 11.15 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 126.723 2.009 . . . . 0.0 111.391 174.061 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 69.0 mt-10 -66.34 -21.79 66.25 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 124.746 1.219 . . . . 0.0 113.958 179.776 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 36.7 tp10 -72.96 -34.66 66.64 Favored 'General case' 0 CA--C 1.542 0.645 0 O-C-N 120.499 -1.376 . . . . 0.0 113.103 -176.54 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 63.7 m -124.13 -13.13 7.33 Favored 'General case' 0 N--CA 1.474 0.749 0 N-CA-C 114.853 1.427 . . . . 0.0 114.853 -178.969 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 84.08 33.14 21.57 Favored Glycine 0 CA--C 1.531 1.055 0 C-N-CA 124.309 0.957 . . . . 0.0 113.209 176.209 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -121.83 -162.63 1.0 Allowed 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 125.14 1.376 . . . . 0.0 109.769 -178.488 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 62.8 m95 -129.18 155.08 46.09 Favored 'General case' 0 CA--C 1.533 0.302 0 O-C-N 121.116 -0.99 . . . . 0.0 111.465 175.431 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 16.2 m -139.37 134.03 39.54 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 C-N-CA 124.788 1.235 . . . . 0.0 112.933 -173.86 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 584' ' ' TRP . . . . . 0.479 ' CD2' HG22 ' A' ' 553' ' ' VAL . 1.0 OUTLIER -86.46 96.91 10.2 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 126.618 1.967 . . . . 0.0 108.331 169.748 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 67.3 mttm -74.34 149.75 40.44 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 124.674 1.19 . . . . 0.0 111.841 -179.838 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 64.79 0.62 1.2 Allowed 'General case' 0 CA--C 1.56 1.331 0 C-N-CA 126.805 2.042 . . . . 0.0 113.895 -172.269 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 54.0 m -94.91 149.05 21.66 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 125.622 1.569 . . . . 0.0 113.658 -171.186 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 14.4 tt -136.65 146.39 28.72 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.63 0 C-N-CA 127.834 2.454 . . . . 0.0 110.262 172.863 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 73.3 tt0 -108.3 126.87 53.33 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 124.632 1.173 . . . . 0.0 110.908 170.74 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 7.7 p -154.12 135.95 5.92 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 C-N-CA 124.951 1.3 . . . . 0.0 111.199 -177.441 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 71.9 m-20 52.54 38.28 25.27 Favored 'General case' 0 CA--C 1.552 1.057 0 C-N-CA 125.177 1.391 . . . . 0.0 113.666 -179.43 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 76.54 11.04 85.54 Favored Glycine 0 CA--C 1.535 1.305 0 C-N-CA 125.33 1.443 . . . . 0.0 115.62 178.438 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 56.8 mtmt -133.01 155.13 49.75 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 125.653 1.581 . . . . 0.0 111.907 -178.312 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 69.9 m-85 -92.48 147.2 23.09 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 124.271 1.028 . . . . 0.0 112.321 175.234 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 90.1 m-85 -152.21 171.12 18.43 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 126.554 1.942 . . . . 0.0 110.241 -174.432 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 596' ' ' HIS . . . . . . . . . . . . . 17.4 m80 -89.8 140.56 29.47 Favored 'General case' 0 N--CA 1.471 0.581 0 O-C-N 121.31 -0.869 . . . . 0.0 109.273 167.54 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 67.6 m -60.14 -41.72 93.31 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 123.391 0.676 . . . . 0.0 112.113 176.724 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 5.6 p -64.81 -42.73 94.77 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 124.977 1.311 . . . . 0.0 112.575 175.981 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 599' ' ' CYS . . . . . . . . . . . . . 90.8 m -65.57 -51.65 58.23 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 124.283 1.033 . . . . 0.0 111.108 177.147 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 83.7 t80 -57.84 -35.1 70.44 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 123.718 0.807 . . . . 0.0 112.608 178.064 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 1.7 m-70 -64.94 -21.63 66.86 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 114.352 1.241 . . . . 0.0 114.352 174.465 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 74.7 mt-10 -90.52 -34.15 15.66 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 119.369 0.986 . . . . 0.0 113.275 171.272 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 69.0 p -92.73 5.49 50.92 Favored 'General case' 0 N--CA 1.482 1.127 0 N-CA-C 114.542 1.312 . . . . 0.0 114.542 -175.057 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 604' ' ' SER . . . . . . . . . . . . . 98.0 p -62.85 -24.73 67.93 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 124.674 1.19 . . . . 0.0 113.97 -177.897 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 605' ' ' GLN . . . . . . . . . . . . . 77.9 mm-40 -98.87 134.32 41.9 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 125.257 1.423 . . . . 0.0 111.767 178.454 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 606' ' ' ASN . . . . . . . . . . . . . 52.3 t30 -76.33 162.66 27.72 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 123.724 0.81 . . . . 0.0 112.666 176.276 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 607' ' ' SER . . . . . . . . . . . . . 81.5 p -73.14 -12.89 61.05 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 114.709 1.374 . . . . 0.0 114.709 177.358 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 608' ' ' SER . . . . . . . . . . . . . 51.4 p . . . . . 0 C--O 1.254 1.306 0 C-N-CA 126.117 1.767 . . . . 0.0 113.993 178.254 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 533' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.508 0 N-CA-C 111.186 -0.766 . . . . 0.0 111.186 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . -77.03 -170.69 33.6 Favored Glycine 0 CA--C 1.538 1.476 0 C-N-CA 124.601 1.096 . . . . 0.0 114.416 175.538 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 535' ' ' SER . . . . . . . . . . . . . 43.3 t -62.78 140.06 58.73 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 124.055 0.942 . . . . 0.0 112.569 177.425 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 536' ' ' GLU . . . . . . . . . . . . . 4.0 pm0 -75.69 -18.42 59.62 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.261 1.025 . . . . 0.0 113.68 176.016 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 537' ' ' PHE . . . . . . . . . . . . . 47.7 t80 -157.73 -61.75 0.09 Allowed 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.993 0.917 . . . . 0.0 112.92 -178.869 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 59.6 p -157.81 172.13 19.05 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 124.747 1.219 . . . . 0.0 112.651 179.149 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 539' ' ' ASP . . . . . . . . . . . . . 41.0 p-10 -76.75 1.23 17.81 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 125.607 1.563 . . . . 0.0 114.731 177.074 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 540' ' ' ARG . . . . . . . . . . . . . 10.9 mpt_? -68.38 145.41 54.18 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 124.186 0.994 . . . . 0.0 112.729 179.1 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 89.4 p -148.63 9.92 0.82 Allowed 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 126.128 1.771 . . . . 0.0 112.46 173.791 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 542' ' ' ASN . . . . . . . . . . . . . 15.2 p-10 -115.39 -9.93 12.07 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 128.27 2.628 . . . . 0.0 113.201 -169.568 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 3.1 pm0 -62.05 -30.71 71.17 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 113.922 1.082 . . . . 0.0 113.922 -171.694 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 63.3 tp -69.66 -39.56 76.98 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.546 0.738 . . . . 0.0 111.793 174.517 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 58.1 mt-10 -83.22 -39.39 20.99 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 124.069 0.948 . . . . 0.0 113.279 -171.869 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 30.1 mm -65.14 -35.69 76.01 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.548 0 C-N-CA 123.359 0.664 . . . . 0.0 110.519 175.558 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -74.31 -22.41 59.28 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 124.216 1.007 . . . . 0.0 113.219 176.416 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -72.61 -13.58 77.9 Favored Glycine 0 CA--C 1.537 1.416 0 C-N-CA 124.709 1.147 . . . . 0.0 115.085 174.941 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -69.08 143.05 54.33 Favored 'General case' 0 N--CA 1.476 0.826 0 CA-C-N 118.272 1.036 . . . . 0.0 111.909 176.882 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 54.8 p90 -151.74 164.5 36.86 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 124.545 1.138 . . . . 0.0 112.634 173.718 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 10.6 m -130.48 139.99 49.94 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 C-N-CA 126.491 1.917 . . . . 0.0 109.07 169.613 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 9.2 p -72.29 136.95 24.54 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.048 0 O-C-N 120.871 -1.143 . . . . 0.0 111.151 -175.781 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 11.9 t -84.06 120.06 74.24 Favored Pre-proline 0 N--CA 1.469 0.519 0 C-N-CA 124.122 0.969 . . . . 0.0 108.534 171.264 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 90.6 Cg_endo -73.56 156.76 49.44 Favored 'Trans proline' 0 CA--C 1.539 0.745 0 C-N-CA 122.724 2.283 . . . . 0.0 112.278 177.782 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -61.26 -24.17 66.19 Favored 'General case' 0 N--CA 1.482 1.168 0 O-C-N 121.473 -0.767 . . . . 0.0 112.656 175.069 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 67.8 p -74.08 -19.91 60.45 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 125.433 1.493 . . . . 0.0 114.136 176.181 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 4.1 m -75.54 95.39 3.31 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 119.073 0.851 . . . . 0.0 110.4 172.959 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 29.0 mt-30 -58.0 -43.17 86.46 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 125.457 1.503 . . . . 0.0 114.022 -169.846 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 63.6 m-20 -94.99 -12.04 27.4 Favored 'General case' 0 CA--C 1.545 0.786 0 N-CA-C 114.185 1.18 . . . . 0.0 114.185 -176.412 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 7.8 mtt 51.4 31.19 6.95 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 126.135 1.774 . . . . 0.0 113.787 -170.982 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -128.08 148.78 50.58 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.294 1.437 . . . . 0.0 112.256 -178.076 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -150.99 171.84 16.65 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 125.256 1.422 . . . . 0.0 109.761 176.186 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 563' ' ' LYS . . . . . . . . . . . . 0.292 0.0 OUTLIER -117.84 156.84 27.68 Favored 'General case' 0 N--CA 1.479 0.979 0 N-CA-C 114.715 1.376 . . . . 0.0 114.715 178.795 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 23.9 t -98.3 109.09 50.9 Favored Pre-proline 0 CA--C 1.539 0.519 0 C-N-CA 127.897 2.479 . . . . 0.0 109.999 169.803 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -62.33 -19.63 67.73 Favored 'Trans proline' 0 C--N 1.352 0.724 0 C-N-CA 123.148 2.565 . . . . 0.0 115.206 174.503 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 90.1 mt -73.78 -61.51 1.67 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.908 0 CA-C-N 119.455 1.025 . . . . 0.0 110.74 -178.756 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 15.7 p -96.19 -0.39 50.02 Favored 'General case' 0 CA--C 1.548 0.888 0 N-CA-C 114.126 1.158 . . . . 0.0 114.126 -177.335 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 568' ' ' LYS . . . . . . . . . . . . . 47.0 mmtm 58.59 46.14 15.14 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 125.904 1.682 . . . . 0.0 112.053 -176.684 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 53.2 mm-40 -117.8 161.12 20.24 Favored 'General case' 0 N--CA 1.484 1.249 0 N-CA-C 113.783 1.031 . . . . 0.0 113.783 -177.057 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 58.4 m -102.82 127.58 49.94 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 124.012 0.925 . . . . 0.0 112.442 -179.134 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 3.1 m -91.46 149.29 4.14 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 C-N-CA 124.651 1.18 . . . . 0.0 110.556 167.901 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 43.8 p -132.45 142.06 49.09 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 125.111 1.364 . . . . 0.0 110.585 174.888 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -67.25 152.49 52.73 Favored Glycine 0 CA--C 1.528 0.891 0 C-N-CA 124.092 0.853 . . . . 0.0 113.489 179.195 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 57.4 t -133.65 133.1 57.23 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.858 0 C-N-CA 125.253 1.421 . . . . 0.0 111.629 176.822 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 44.8 t80 -70.12 128.18 35.39 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 114.052 1.13 . . . . 0.0 114.052 -173.051 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 13.4 t0 -98.02 114.05 26.09 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 125.365 1.466 . . . . 0.0 109.02 168.409 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 9.7 mp0 -72.83 -27.24 61.83 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 114.242 1.201 . . . . 0.0 114.242 -173.95 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -83.26 -44.38 15.02 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 123.904 0.881 . . . . 0.0 112.058 179.869 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 59.8 m -71.85 -30.22 65.22 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.21 0.604 . . . . 0.0 112.249 171.884 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 77.4 26.37 61.56 Favored Glycine 0 CA--C 1.534 1.227 0 C-N-CA 124.797 1.189 . . . . 0.0 112.978 -177.905 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 55.0 mt-10 -142.43 150.94 41.26 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 125.598 1.559 . . . . 0.0 110.434 -171.49 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 43.3 m95 -84.67 151.78 24.22 Favored 'General case' 0 CA--C 1.543 0.677 0 O-C-N 121.204 -0.935 . . . . 0.0 111.23 179.629 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 17.3 m -134.39 139.35 48.15 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.31 0 C-N-CA 125.227 1.411 . . . . 0.0 112.792 -176.482 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 2.6 m0 -89.64 100.8 13.53 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 126.399 1.88 . . . . 0.0 107.855 171.27 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 53.2 mtmt -78.76 157.96 28.37 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 124.395 1.078 . . . . 0.0 112.024 179.809 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 9.1 t30 54.58 30.7 13.64 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 125.265 1.426 . . . . 0.0 113.047 -174.227 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 86.1 m -122.52 148.12 45.55 Favored 'General case' 0 N--CA 1.48 1.036 0 O-C-N 121.0 -1.063 . . . . 0.0 112.15 -169.774 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 15.6 tt -138.25 142.35 35.61 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 C-N-CA 127.313 2.245 . . . . 0.0 110.973 178.664 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 77.8 tt0 -102.96 127.27 50.25 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.457 1.103 . . . . 0.0 110.224 169.388 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 7.6 p -152.67 133.24 4.28 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 C-N-CA 125.113 1.365 . . . . 0.0 110.819 -178.971 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 74.9 m-20 53.96 41.71 31.93 Favored 'General case' 0 CA--C 1.551 0.986 0 C-N-CA 124.801 1.24 . . . . 0.0 113.104 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 73.7 11.26 80.61 Favored Glycine 0 CA--C 1.536 1.396 0 C-N-CA 124.813 1.197 . . . . 0.0 115.551 179.141 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 36.3 mtmm -134.96 156.13 49.55 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 126.341 1.857 . . . . 0.0 111.849 -173.418 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 75.9 m-85 -100.03 146.13 27.1 Favored 'General case' 0 N--CA 1.464 0.25 0 C-N-CA 124.364 1.066 . . . . 0.0 113.282 179.412 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 86.5 m-85 -151.76 165.9 33.0 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 126.592 1.957 . . . . 0.0 110.366 -173.913 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 596' ' ' HIS . . . . . 0.424 ' HB2' ' HB2' ' A' ' 599' ' ' CYS . 20.7 m80 -81.09 142.97 32.78 Favored 'General case' 0 N--CA 1.468 0.44 0 O-C-N 121.381 -0.824 . . . . 0.0 109.491 168.77 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 66.9 p -60.88 -44.79 96.59 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 123.919 0.888 . . . . 0.0 111.681 176.942 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 18.7 p -63.99 -44.7 91.89 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 125.023 1.329 . . . . 0.0 112.93 175.322 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 599' ' ' CYS . . . . . 0.424 ' HB2' ' HB2' ' A' ' 596' ' ' HIS . 97.5 m -60.97 -45.47 94.63 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.587 1.155 . . . . 0.0 111.792 178.605 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 84.2 t80 -72.95 -32.17 65.07 Favored 'General case' 0 CA--C 1.546 0.804 0 N-CA-C 113.382 0.882 . . . . 0.0 113.382 177.556 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 57.4 t-80 -75.16 -81.67 0.07 Allowed 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 114.706 1.373 . . . . 0.0 114.706 -174.178 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -95.93 -6.96 37.89 Favored 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 113.616 0.969 . . . . 0.0 113.616 -174.253 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 1.5 m -91.81 -47.75 7.17 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.585 1.154 . . . . 0.0 111.996 -177.975 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 604' ' ' SER . . . . . . . . . . . . . 22.6 t -70.41 152.51 43.99 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 123.512 0.725 . . . . 0.0 111.233 171.736 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 605' ' ' GLN . . . . . . . . . . . . . 60.6 tt0 -64.8 123.1 18.5 Favored 'General case' 0 CA--C 1.541 0.621 0 O-C-N 121.409 -0.807 . . . . 0.0 110.673 177.472 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 606' ' ' ASN . . . . . . . . . . . . . 59.0 t30 -69.69 130.71 43.11 Favored 'General case' 0 CA--C 1.545 0.767 0 N-CA-C 113.242 0.83 . . . . 0.0 113.242 -169.894 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 607' ' ' SER . . . . . . . . . . . . . 42.0 m -78.66 163.98 25.0 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.997 1.319 . . . . 0.0 112.707 173.917 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 608' ' ' SER . . . . . . . . . . . . . 53.4 p . . . . . 0 C--O 1.252 1.234 0 C-N-CA 125.125 1.37 . . . . 0.0 113.309 170.821 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 533' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.545 0 N-CA-C 111.322 -0.711 . . . . 0.0 111.322 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . -82.4 -153.1 11.61 Favored Glycine 0 CA--C 1.537 1.453 0 C-N-CA 124.587 1.089 . . . . 0.0 113.586 176.106 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 535' ' ' SER . . . . . . . . . . . . . 77.8 p -67.37 -15.6 63.77 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 124.502 1.121 . . . . 0.0 113.488 172.212 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 536' ' ' GLU . . . . . . . . . . . . . 45.4 tt0 -138.85 125.13 20.29 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 126.565 1.946 . . . . 0.0 109.958 173.717 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 537' ' ' PHE . . . . . . . . . . . . . 38.6 p90 -158.45 172.53 18.16 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.188 1.395 . . . . 0.0 111.543 -178.761 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 16.8 t -149.3 159.76 43.99 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 125.164 1.385 . . . . 0.0 111.758 179.489 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 539' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -147.32 171.28 15.67 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 125.478 1.511 . . . . 0.0 112.045 -177.689 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 540' ' ' ARG . . . . . . . . . . . . . 77.3 mmt-85 -121.29 18.94 11.47 Favored 'General case' 0 N--CA 1.479 1.016 0 N-CA-C 114.542 1.312 . . . . 0.0 114.542 -171.088 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 44.2 t -62.2 119.39 8.91 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 121.635 -0.666 . . . . 0.0 110.94 175.019 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 542' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -78.13 -19.8 53.37 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 123.386 0.674 . . . . 0.0 111.769 176.648 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -63.18 -28.96 70.41 Favored 'General case' 0 CA--C 1.54 0.558 0 N-CA-C 113.465 0.913 . . . . 0.0 113.465 -170.615 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -65.03 -40.89 95.5 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.003 0.921 . . . . 0.0 111.488 174.197 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 75.7 mm-40 -76.07 -30.55 58.4 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.76 0.824 . . . . 0.0 112.661 178.101 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 11.2 mm -66.34 -40.97 88.08 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.599 0 C-N-CA 123.991 0.916 . . . . 0.0 110.297 169.083 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 79.7 ttt180 -65.94 -28.92 69.28 Favored 'General case' 0 N--CA 1.478 0.927 0 O-C-N 121.125 -0.984 . . . . 0.0 112.173 -179.202 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -71.96 -7.55 66.65 Favored Glycine 0 CA--C 1.542 1.734 0 C-N-CA 124.706 1.146 . . . . 0.0 115.428 175.061 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 41.8 mmtm -70.3 144.66 51.67 Favored 'General case' 0 N--CA 1.479 0.996 0 CA-C-N 119.771 1.786 . . . . 0.0 111.227 177.858 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 40.2 p90 -149.29 166.47 28.86 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 113.937 1.088 . . . . 0.0 113.937 178.198 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 4.8 m -136.74 138.84 45.8 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.841 0 C-N-CA 126.801 2.04 . . . . 0.0 109.73 174.992 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 44.0 t -70.29 133.98 30.88 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 O-C-N 121.084 -1.01 . . . . 0.0 110.998 -177.972 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 3.1 t -91.88 124.31 60.63 Favored Pre-proline 0 N--CA 1.471 0.591 0 C-N-CA 124.273 1.029 . . . . 0.0 111.639 178.198 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 62.1 Cg_endo -80.48 152.46 20.32 Favored 'Trans proline' 0 CA--C 1.538 0.714 0 C-N-CA 123.274 2.649 . . . . 0.0 111.638 169.893 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -66.77 -18.32 65.31 Favored 'General case' 0 CA--C 1.548 0.88 0 O-C-N 120.401 -1.437 . . . . 0.0 113.103 175.954 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -71.73 -22.65 61.6 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 124.877 1.271 . . . . 0.0 113.44 173.204 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 9.6 m -73.51 121.63 20.9 Favored 'General case' 0 N--CA 1.473 0.702 0 O-C-N 121.497 -0.752 . . . . 0.0 110.328 170.919 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 55.2 tp60 -53.41 116.09 2.26 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 125.077 1.351 . . . . 0.0 112.484 -168.514 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 53.31 20.95 2.1 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 126.559 1.944 . . . . 0.0 114.822 177.789 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 28.6 mtt 53.47 33.08 15.27 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 125.522 1.529 . . . . 0.0 113.443 -168.834 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -126.95 134.65 50.36 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 125.031 1.332 . . . . 0.0 112.544 -177.053 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 41.6 t80 -148.21 161.33 41.69 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 124.861 1.264 . . . . 0.0 110.041 174.948 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 3.5 ttmp? -112.67 131.26 55.73 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 123.827 0.851 . . . . 0.0 113.001 -171.996 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 22.6 t -68.11 111.77 8.8 Favored Pre-proline 0 CA--C 1.541 0.633 0 C-N-CA 126.064 1.745 . . . . 0.0 109.479 168.644 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -69.83 -17.34 37.32 Favored 'Trans proline' 0 CA--C 1.54 0.815 0 C-N-CA 122.515 2.143 . . . . 0.0 113.349 177.691 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 86.8 mt -70.28 -51.54 37.63 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.672 0 C-N-CA 124.593 1.157 . . . . 0.0 110.898 -177.706 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 14.6 p -110.75 -0.86 16.89 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 124.729 1.212 . . . . 0.0 114.071 -178.877 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 568' ' ' LYS . . . . . . . . . . . . . 34.1 mmtp 60.64 45.86 9.88 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 126.604 1.962 . . . . 0.0 113.352 -177.0 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 74.7 mt-10 -120.79 138.67 53.91 Favored 'General case' 0 N--CA 1.481 1.078 0 N-CA-C 113.746 1.017 . . . . 0.0 113.746 -175.927 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 97.1 m -83.77 121.48 27.36 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.256 0.622 . . . . 0.0 112.181 -179.234 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 1.7 m -88.11 143.65 10.82 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 C-N-CA 125.22 1.408 . . . . 0.0 110.364 168.172 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 69.1 p -124.62 142.77 51.13 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 124.971 1.309 . . . . 0.0 111.629 -179.187 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -74.97 145.55 33.8 Favored Glycine 0 CA--C 1.53 0.988 0 C-N-CA 124.302 0.953 . . . . 0.0 113.372 179.065 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 61.6 t -135.32 141.6 42.11 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.875 0 C-N-CA 125.599 1.56 . . . . 0.0 111.554 -177.336 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 62.1 t80 -70.52 127.39 32.55 Favored 'General case' 0 CA--C 1.542 0.64 0 O-C-N 121.277 -0.889 . . . . 0.0 112.976 -176.697 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 65.1 t0 -94.12 104.21 16.24 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 127.072 2.149 . . . . 0.0 109.892 170.015 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -66.89 -26.97 67.14 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.072 1.349 . . . . 0.0 114.45 -177.624 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 31.8 tp10 -78.66 -44.31 24.04 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 123.609 0.763 . . . . 0.0 111.713 -178.983 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 22.8 t -81.57 -35.32 30.37 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 124.903 1.281 . . . . 0.0 112.276 177.219 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 84.17 32.81 22.18 Favored Glycine 0 CA--C 1.53 1.031 0 C-N-CA 124.513 1.054 . . . . 0.0 113.468 -172.736 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 81.8 mm-40 -130.16 178.54 6.48 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.479 1.512 . . . . 0.0 110.705 -175.537 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 68.6 m95 -111.25 145.4 38.82 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 121.015 -1.053 . . . . 0.0 110.251 171.955 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 13.8 m -137.72 138.04 44.68 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.892 0 C-N-CA 124.985 1.314 . . . . 0.0 113.227 -172.057 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 0.8 OUTLIER -87.26 100.95 13.07 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 126.327 1.851 . . . . 0.0 107.228 169.952 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 56.7 mtmt -73.56 157.03 37.46 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 124.184 0.993 . . . . 0.0 111.253 177.093 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 55.2 33.4 20.48 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 125.307 1.443 . . . . 0.0 112.392 -176.407 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 55.2 m -130.36 147.78 52.1 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 124.71 1.204 . . . . 0.0 112.239 -169.432 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 14.7 tt -136.41 144.16 33.61 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.718 0 C-N-CA 126.978 2.111 . . . . 0.0 111.096 178.543 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -105.89 135.79 46.7 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 125.243 1.417 . . . . 0.0 110.157 168.722 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 7.5 p -147.66 123.51 2.64 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.619 0 C-N-CA 124.289 1.036 . . . . 0.0 111.006 173.88 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 69.9 m-20 51.08 36.58 15.78 Favored 'General case' 0 CA--C 1.551 1.003 0 C-N-CA 125.472 1.509 . . . . 0.0 114.245 175.402 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 89.15 -9.19 77.82 Favored Glycine 0 CA--C 1.536 1.405 0 C-N-CA 125.32 1.438 . . . . 0.0 115.633 -179.221 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 63.4 mttp -95.87 153.77 17.58 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 125.578 1.551 . . . . 0.0 111.78 176.329 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 69.1 m-85 -113.38 142.75 45.5 Favored 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 125.0 1.32 . . . . 0.0 112.259 174.485 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 16.3 m-85 -149.18 159.01 44.63 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 126.307 1.843 . . . . 0.0 110.6 -173.569 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 596' ' ' HIS . . . . . . . . . . . . . 11.8 m80 -71.31 139.13 49.81 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 106.539 -1.652 . . . . 0.0 106.539 165.555 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 72.8 p -59.3 -43.0 92.65 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 122.995 0.518 . . . . 0.0 111.935 178.603 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 14.1 p -71.59 -33.41 69.01 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 125.362 1.465 . . . . 0.0 113.693 178.144 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 599' ' ' CYS . . . . . . . . . . . . . 99.3 m -66.68 -52.46 44.57 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.657 0.783 . . . . 0.0 111.021 172.495 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 66.1 t80 -57.53 -40.67 79.32 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 123.183 0.593 . . . . 0.0 111.955 176.73 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 69.8 t60 -56.36 -46.84 79.82 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.837 1.255 . . . . 0.0 113.872 175.384 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -77.76 -23.75 49.15 Favored 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 114.044 1.127 . . . . 0.0 114.044 174.992 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 68.4 m -77.38 -29.21 53.14 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 124.939 1.296 . . . . 0.0 112.714 179.227 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 604' ' ' SER . . . . . . . . . . . . . 33.4 t -56.48 112.1 1.17 Allowed 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.817 1.247 . . . . 0.0 112.809 -174.664 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 605' ' ' GLN . . . . . . . . . . . . . 43.1 tp60 -160.3 -39.39 0.05 Allowed 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 126.475 1.91 . . . . 0.0 111.571 -176.347 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 606' ' ' ASN . . . . . . . . . . . . . 14.8 p-10 -72.13 -9.07 57.92 Favored 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 125.995 1.718 . . . . 0.0 114.404 174.62 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 607' ' ' SER . . . . . . . . . . . . . 20.4 m -62.97 141.98 58.53 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 125.541 1.536 . . . . 0.0 113.29 -175.649 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 608' ' ' SER . . . . . . . . . . . . . 39.2 m . . . . . 0 C--O 1.253 1.269 0 C-N-CA 125.578 1.551 . . . . 0.0 114.05 179.066 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 533' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.71 0 N-CA-C 111.866 -0.494 . . . . 0.0 111.866 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 72.35 22.69 78.79 Favored Glycine 0 CA--C 1.538 1.489 0 O-C-N 121.76 -0.847 . . . . 0.0 115.197 177.385 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 535' ' ' SER . . . . . . . . . . . . . 71.4 p -68.68 -15.25 63.46 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 124.949 1.299 . . . . 0.0 114.438 -178.474 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 536' ' ' GLU . . . . . . . . . . . . . 11.9 tp10 -141.5 110.24 6.11 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 125.655 1.582 . . . . 0.0 108.928 171.635 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 537' ' ' PHE . . . . . . . . . . . . . 42.6 p90 -73.66 -20.69 60.49 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 115.294 1.59 . . . . 0.0 115.294 -169.238 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 69.1 m -110.54 -4.2 15.6 Favored 'General case' 0 N--CA 1.48 1.058 0 N-CA-C 114.667 1.358 . . . . 0.0 114.667 179.4 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 539' ' ' ASP . . . . . . . . . . . . . 12.0 t0 56.82 -165.75 0.14 Allowed 'General case' 0 CA--C 1.559 1.325 0 C-N-CA 124.65 1.18 . . . . 0.0 111.342 -168.245 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 540' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.81 -16.84 63.62 Favored 'General case' 0 N--CA 1.484 1.238 0 O-C-N 119.931 -1.731 . . . . 0.0 114.183 174.782 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 20.3 m -65.62 130.84 44.71 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 125.535 1.534 . . . . 0.0 111.793 -179.035 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 542' ' ' ASN . . . . . . . . . . . . . 45.9 m-80 -140.64 120.28 13.33 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 125.212 1.405 . . . . 0.0 110.639 -179.655 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 16.8 pt-20 -152.3 -29.61 0.16 Allowed 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 124.475 1.11 . . . . 0.0 113.927 179.596 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 86.7 mt -67.64 -30.88 70.56 Favored 'General case' 0 N--CA 1.472 0.671 0 O-C-N 121.48 -0.762 . . . . 0.0 112.468 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 18.0 tp10 -64.56 -30.49 71.51 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.524 1.13 . . . . 0.0 112.49 176.589 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 18.5 mm -62.78 -34.77 67.59 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 124.952 1.301 . . . . 0.0 111.454 -178.567 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 45.0 ttt180 -61.34 -21.66 64.21 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.518 1.127 . . . . 0.0 112.879 179.442 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -71.79 -11.67 73.75 Favored Glycine 0 CA--C 1.539 1.569 0 C-N-CA 124.643 1.116 . . . . 0.0 115.251 176.03 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -69.76 146.32 51.55 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-N 119.201 1.501 . . . . 0.0 112.18 173.417 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 47.6 p90 -156.5 166.52 33.18 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 124.955 1.302 . . . . 0.0 111.772 171.59 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 2.5 m -128.93 133.5 66.0 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 C-N-CA 124.618 1.167 . . . . 0.0 109.745 170.479 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 53.3 t -68.23 132.41 32.78 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 O-C-N 121.26 -0.9 . . . . 0.0 110.113 -179.796 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 22.4 t -78.97 119.08 75.94 Favored Pre-proline 0 N--CA 1.472 0.651 0 CA-C-O 118.483 -0.77 . . . . 0.0 110.588 -179.239 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 65.3 Cg_endo -78.82 156.24 27.24 Favored 'Trans proline' 0 CA--C 1.537 0.643 0 C-N-CA 123.126 2.551 . . . . 0.0 112.15 176.84 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -67.47 -17.81 64.83 Favored 'General case' 0 N--CA 1.474 0.738 0 O-C-N 121.486 -0.759 . . . . 0.0 112.884 176.885 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 66.8 p -74.06 -22.99 59.31 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 125.02 1.328 . . . . 0.0 113.493 173.913 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 24.7 m -80.2 112.09 17.18 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 123.997 0.919 . . . . 0.0 111.683 175.258 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -62.08 136.22 57.85 Favored 'General case' 0 CA--C 1.546 0.824 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 -173.667 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 33.8 m-20 53.92 15.32 0.83 Allowed 'General case' 0 CA--C 1.553 1.073 0 C-N-CA 126.733 2.013 . . . . 0.0 115.418 176.918 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 18.9 mtt 51.35 31.93 7.78 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 125.672 1.589 . . . . 0.0 114.659 -171.494 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -123.95 142.67 50.95 Favored 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 113.851 1.056 . . . . 0.0 113.851 -174.526 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 6.5 t80 -153.91 -179.97 8.35 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 125.919 1.688 . . . . 0.0 109.963 173.378 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 18.1 ttmm -130.56 152.91 49.42 Favored 'General case' 0 N--CA 1.48 1.032 0 O-C-N 120.628 -1.295 . . . . 0.0 113.385 -175.273 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 19.2 t -95.9 107.0 31.5 Favored Pre-proline 0 CA--C 1.543 0.71 0 C-N-CA 127.865 2.466 . . . . 0.0 110.307 170.865 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_exo -62.38 -20.45 70.37 Favored 'Trans proline' 0 CA--C 1.546 1.086 0 C-N-CA 122.268 1.979 . . . . 0.0 115.736 174.71 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 88.7 mt -69.38 -52.26 34.51 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 C-N-CA 124.266 1.026 . . . . 0.0 111.35 -177.205 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 14.9 p -108.62 -0.71 20.06 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 124.328 1.051 . . . . 0.0 113.717 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 568' ' ' LYS . . . . . . . . . . . . . 95.1 mttt 59.82 44.43 13.88 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 126.966 2.106 . . . . 0.0 113.151 -177.571 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 64.8 mt-10 -112.0 138.93 47.97 Favored 'General case' 0 N--CA 1.479 0.995 0 N-CA-C 113.488 0.922 . . . . 0.0 113.488 -177.697 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 57.7 m -85.71 121.24 28.1 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 123.216 0.606 . . . . 0.0 111.037 177.778 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 3.8 m -88.4 144.15 9.76 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 C-N-CA 125.442 1.497 . . . . 0.0 110.502 170.414 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 74.6 p -128.94 144.81 51.29 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.976 1.311 . . . . 0.0 110.799 174.274 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -72.03 141.06 30.95 Favored Glycine 0 CA--C 1.525 0.677 0 C-N-CA 124.152 0.882 . . . . 0.0 112.547 -178.138 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 33.3 m -132.63 139.72 49.18 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 C-N-CA 124.497 1.119 . . . . 0.0 112.001 -178.545 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 79.2 t80 -75.32 113.69 12.99 Favored 'General case' 0 CA--C 1.54 0.589 0 O-C-N 121.4 -0.813 . . . . 0.0 111.284 179.581 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -82.3 118.21 22.97 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.371 1.068 . . . . 0.0 110.447 170.67 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 11.6 mp0 -73.87 -28.11 61.41 Favored 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 114.017 1.117 . . . . 0.0 114.017 -173.335 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 32.8 tp10 -81.52 -41.92 20.97 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.228 1.011 . . . . 0.0 111.914 -179.41 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 36.0 t -74.62 -35.88 62.93 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 125.016 1.326 . . . . 0.0 112.015 173.072 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 80.91 33.1 30.79 Favored Glycine 0 CA--C 1.534 1.246 0 C-N-CA 124.491 1.043 . . . . 0.0 113.053 -177.042 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 69.9 mm-40 -144.93 149.95 36.15 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 125.138 1.375 . . . . 0.0 111.716 -171.518 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 84.5 m95 -76.89 134.5 38.96 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 122.723 0.409 . . . . 0.0 110.555 170.032 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 8.1 m -139.41 145.05 27.71 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 C-N-CA 124.658 1.183 . . . . 0.0 113.007 -168.765 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 2.8 m0 -93.81 97.6 10.52 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 106.715 -1.587 . . . . 0.0 106.715 167.623 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 61.6 mttm -74.32 145.07 44.21 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 124.447 1.099 . . . . 0.0 111.959 -175.987 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 62.9 t30 52.16 37.12 20.91 Favored 'General case' 0 CA--C 1.551 0.994 0 C-N-CA 126.33 1.852 . . . . 0.0 113.201 -170.588 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 88.4 m -119.18 147.13 44.55 Favored 'General case' 0 N--CA 1.481 1.108 0 O-C-N 120.67 -1.269 . . . . 0.0 112.252 -176.148 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 13.2 tt -136.66 145.65 29.94 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.64 0 C-N-CA 127.888 2.475 . . . . 0.0 110.719 -178.9 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 73.5 tt0 -105.7 125.68 51.27 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.569 1.148 . . . . 0.0 110.564 169.793 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 8.3 p -158.93 145.84 7.5 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 C-N-CA 124.997 1.319 . . . . 0.0 110.655 179.876 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 53.9 t30 53.01 38.73 28.04 Favored 'General case' 0 CA--C 1.554 1.111 0 C-N-CA 124.431 1.092 . . . . 0.0 112.55 -177.996 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 65.95 14.89 61.81 Favored Glycine 0 CA--C 1.534 1.257 0 C-N-CA 125.51 1.529 . . . . 0.0 115.971 -179.844 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 35.8 mtmm -134.83 159.95 39.76 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 126.349 1.86 . . . . 0.0 110.938 -177.278 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 70.4 m-85 -91.03 149.7 21.73 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-O 121.979 0.895 . . . . 0.0 112.08 169.866 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 9.8 m-85 -145.9 165.31 29.31 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 127.283 2.233 . . . . 0.0 109.387 177.576 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 596' ' ' HIS . . . . . . . . . . . . . 26.7 m80 -77.94 141.88 38.73 Favored 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 108.161 -1.052 . . . . 0.0 108.161 166.102 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 8.4 t -65.94 -41.73 90.94 Favored 'General case' 0 N--CA 1.466 0.353 0 O-C-N 121.805 -0.559 . . . . 0.0 112.018 -177.186 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 22.3 p -64.72 -42.64 95.09 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 123.608 0.763 . . . . 0.0 112.683 173.666 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 599' ' ' CYS . . . . . . . . . . . . . 64.2 m -56.14 -58.27 8.66 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.589 1.155 . . . . 0.0 110.824 174.617 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 76.5 t80 -58.69 -46.77 86.51 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.414 0.686 . . . . 0.0 112.456 179.793 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 33.9 t-80 -58.73 -47.21 85.39 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 124.102 0.961 . . . . 0.0 113.129 -176.662 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 35.5 tp10 -77.29 -30.5 54.23 Favored 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 112.72 0.637 . . . . 0.0 112.72 -179.902 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 98.6 m -81.21 -34.03 32.52 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.761 0.825 . . . . 0.0 112.981 -176.787 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 604' ' ' SER . . . . . . . . . . . . . 38.0 t -64.06 129.93 41.97 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 124.254 1.022 . . . . 0.0 112.915 -174.068 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 605' ' ' GLN . . . . . . . . . . . . . 14.4 tt0 -115.48 135.78 53.75 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.869 1.668 . . . . 0.0 109.867 172.804 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 606' ' ' ASN . . . . . . . . . . . . . 56.3 m-80 -139.13 154.52 48.12 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.153 1.381 . . . . 0.0 111.837 -171.481 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 607' ' ' SER . . . . . . . . . . . . . 17.4 t -71.39 151.29 44.2 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.609 1.164 . . . . 0.0 112.479 178.788 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 608' ' ' SER . . . . . . . . . . . . . 46.1 m . . . . . 0 C--O 1.255 1.37 0 C-N-CA 126.062 1.745 . . . . 0.0 113.816 -177.209 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 533' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.371 0 N-CA-C 111.088 -0.805 . . . . 0.0 111.088 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 104.38 17.14 16.2 Favored Glycine 0 CA--C 1.538 1.529 0 C-N-CA 125.354 1.454 . . . . 0.0 115.574 178.746 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 535' ' ' SER . . . . . . . . . . . . . 23.4 t -139.18 -15.32 1.12 Allowed 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 125.042 1.337 . . . . 0.0 113.722 -178.989 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 536' ' ' GLU . . . . . . . . . . . . . 18.9 mp0 -68.84 6.06 0.97 Allowed 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 127.164 2.186 . . . . 0.0 115.953 -170.918 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 537' ' ' PHE . . . . . . . . . . . . . 47.6 p90 -67.32 -18.14 65.05 Favored 'General case' 0 CA--C 1.546 0.802 0 O-C-N 120.527 -1.358 . . . . 0.0 112.77 169.531 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 96.7 p -150.76 157.27 42.74 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 126.192 1.797 . . . . 0.0 110.596 169.519 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 539' ' ' ASP . . . . . . . . . . . . . 30.8 m-20 -142.53 154.35 44.41 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 124.555 1.142 . . . . 0.0 112.958 -175.974 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 540' ' ' ARG . . . . . . . . . . . . . 30.8 mmt180 -89.13 22.95 2.59 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 125.605 1.562 . . . . 0.0 112.424 170.659 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 92.9 p -74.96 175.56 8.0 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 126.351 1.86 . . . . 0.0 113.279 -172.55 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 542' ' ' ASN . . . . . . . . . . . . . 29.1 m120 -63.35 -11.42 22.32 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 114.039 1.126 . . . . 0.0 114.039 178.731 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 22.0 tp10 -52.78 -53.21 51.42 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-N 119.993 1.269 . . . . 0.0 111.977 178.711 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 85.7 mt -65.49 -33.14 75.25 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 123.5 0.72 . . . . 0.0 112.438 179.404 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -73.78 -41.63 62.14 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 124.092 0.957 . . . . 0.0 112.651 -177.321 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 33.9 mm -71.46 -31.61 43.52 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.658 0 C-N-CA 124.342 1.057 . . . . 0.0 110.847 173.451 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 19.0 tpp180 -68.14 -34.62 76.7 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 124.333 1.053 . . . . 0.0 111.767 175.896 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -72.61 -6.14 65.73 Favored Glycine 0 CA--C 1.537 1.424 0 C-N-CA 125.76 1.648 . . . . 0.0 115.645 177.176 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 73.4 mmtt -76.67 125.84 29.94 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-N 119.576 1.688 . . . . 0.0 110.289 171.897 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 39.5 p90 -149.29 162.89 39.15 Favored 'General case' 0 C--O 1.237 0.404 0 N-CA-C 113.277 0.843 . . . . 0.0 113.277 176.619 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -135.68 138.13 48.37 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.485 0 C-N-CA 126.274 1.83 . . . . 0.0 110.422 179.044 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 76.2 t -70.54 134.92 29.18 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.939 0 C-N-CA 123.821 0.849 . . . . 0.0 110.812 -175.61 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 72.7 t -64.96 121.79 75.87 Favored Pre-proline 0 CA--C 1.544 0.719 0 C-N-CA 124.22 1.008 . . . . 0.0 108.957 173.491 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -87.0 -9.11 6.42 Favored 'Trans proline' 0 CA--C 1.536 0.586 0 C-N-CA 124.583 3.522 . . . . 0.0 114.54 -169.144 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 63.48 -24.63 0.07 Allowed 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 127.826 2.45 . . . . 0.0 114.627 -168.408 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 80.6 p -64.53 -18.91 65.26 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 124.989 1.315 . . . . 0.0 111.995 169.333 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 33.5 p -65.56 -8.24 18.86 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 126.692 1.997 . . . . 0.0 114.184 168.493 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? 68.26 -36.78 0.32 Allowed 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 128.408 2.683 . . . . 0.0 116.644 169.751 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 28.9 t0 -125.54 14.24 8.17 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 125.167 1.387 . . . . 0.0 113.45 178.319 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 80.2 mtp 56.63 22.48 6.77 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 126.276 1.83 . . . . 0.0 114.368 -179.49 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -133.3 152.51 51.93 Favored 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 125.818 1.647 . . . . 0.0 112.012 -170.089 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 10.5 m-85 -148.82 156.43 42.33 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 125.527 1.531 . . . . 0.0 111.823 171.495 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 47.2 tttp -85.81 153.01 22.57 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 124.385 1.074 . . . . 0.0 113.248 -178.634 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 13.7 t -104.89 101.78 31.49 Favored Pre-proline 0 CA--C 1.547 0.831 0 C-N-CA 126.559 1.943 . . . . 0.0 109.128 165.017 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -61.33 -21.16 71.02 Favored 'Trans proline' 0 CA--C 1.541 0.825 0 C-N-CA 122.726 2.284 . . . . 0.0 115.496 176.76 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 89.3 mt -72.87 -58.07 5.71 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 C-N-CA 124.495 1.118 . . . . 0.0 111.658 -177.691 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 14.4 p -98.12 2.62 48.77 Favored 'General case' 0 CA--C 1.552 1.055 0 C-N-CA 123.977 0.911 . . . . 0.0 113.346 179.406 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 568' ' ' LYS . . . . . . . . . . . . 0.326 20.1 ptpt 54.85 42.85 30.81 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 127.566 2.346 . . . . 0.0 113.434 -177.401 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 71.2 mm-40 -109.84 -177.27 3.22 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.624 0.77 . . . . 0.0 112.196 179.26 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 64.4 m -132.34 120.99 22.82 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 124.556 1.142 . . . . 0.0 110.977 178.218 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -81.74 149.77 4.73 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 C-N-CA 124.456 1.102 . . . . 0.0 110.258 168.056 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 3.4 t -149.0 155.62 41.06 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.969 0.907 . . . . 0.0 112.388 171.436 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -58.47 148.28 38.09 Favored Glycine 0 CA--C 1.534 1.251 0 C-N-CA 126.18 1.848 . . . . 0.0 116.661 -168.648 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 60.8 t -136.2 132.6 49.76 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 C-N-CA 125.691 1.596 . . . . 0.0 111.567 173.413 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 57.7 t80 -73.67 127.69 33.46 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 113.327 0.862 . . . . 0.0 113.327 -175.113 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 22.7 t0 -99.37 122.76 42.95 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 125.705 1.602 . . . . 0.0 110.45 169.237 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 64.7 mt-10 -73.55 -24.27 60.1 Favored 'General case' 0 CA--C 1.544 0.74 0 N-CA-C 113.793 1.035 . . . . 0.0 113.793 177.94 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -77.16 -52.48 9.2 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 119.401 1.001 . . . . 0.0 112.115 -176.234 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 89.9 p -74.42 -24.98 59.17 Favored 'General case' 0 N--CA 1.479 0.995 0 O-C-N 121.548 -0.72 . . . . 0.0 112.048 169.296 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 78.31 28.81 55.06 Favored Glycine 0 CA--C 1.536 1.403 0 C-N-CA 124.501 1.048 . . . . 0.0 113.15 -179.62 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -143.2 159.03 43.07 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.718 1.607 . . . . 0.0 112.645 -172.304 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 82.3 m95 -78.73 137.39 37.75 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.805 0.842 . . . . 0.0 111.677 176.946 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 19.2 m -130.0 151.28 35.62 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.762 0 C-N-CA 126.261 1.824 . . . . 0.0 112.912 -178.032 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 5.7 m0 -97.09 104.35 16.36 Favored 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 126.452 1.901 . . . . 0.0 110.553 169.321 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -70.87 148.39 47.85 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 124.221 1.009 . . . . 0.0 111.987 179.091 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 48.3 t30 50.45 45.48 26.34 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 124.855 1.262 . . . . 0.0 112.518 -179.785 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 94.2 m -130.93 145.84 52.15 Favored 'General case' 0 N--CA 1.48 1.052 0 N-CA-C 113.95 1.092 . . . . 0.0 113.95 -170.113 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 8.3 tt -143.33 151.72 16.89 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.62 0 C-N-CA 128.078 2.551 . . . . 0.0 110.477 -177.792 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 73.1 tt0 -119.03 126.8 52.55 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.338 1.455 . . . . 0.0 109.792 169.696 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 2.8 t -142.01 131.98 24.22 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 C-N-CA 126.78 2.032 . . . . 0.0 109.868 -175.795 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 16.5 m120 52.44 36.87 21.22 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 124.91 1.284 . . . . 0.0 113.931 178.981 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 78.67 8.93 87.47 Favored Glycine 0 CA--C 1.54 1.625 0 C-N-CA 124.796 1.189 . . . . 0.0 115.518 -179.752 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 53.0 mtmt -126.56 148.57 49.73 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 126.209 1.804 . . . . 0.0 111.431 -178.646 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 20.9 m-85 -89.58 149.12 22.99 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.167 0.987 . . . . 0.0 111.979 177.004 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 94.2 m-85 -151.34 162.85 40.18 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 125.783 1.633 . . . . 0.0 111.345 -179.995 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 596' ' ' HIS . . . . . 0.407 ' HB2' ' HB2' ' A' ' 599' ' ' CYS . 24.6 m80 -78.44 140.58 38.64 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 167.901 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 19.7 m -64.86 -39.52 93.68 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 118.36 0.527 . . . . 0.0 111.673 179.223 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 22.6 p -62.4 -46.08 90.24 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 123.721 0.808 . . . . 0.0 112.943 172.781 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 599' ' ' CYS . . . . . 0.407 ' HB2' ' HB2' ' A' ' 596' ' ' HIS . 94.0 m -60.04 -54.41 46.35 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 124.226 1.01 . . . . 0.0 111.312 177.883 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 89.7 t80 -62.32 -41.71 98.77 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.293 0.637 . . . . 0.0 112.126 -179.18 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 12.9 t-160 -61.29 -44.36 97.34 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.087 0.955 . . . . 0.0 112.388 176.348 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 25.8 tt0 -71.94 -34.39 68.98 Favored 'General case' 0 CA--C 1.545 0.788 0 N-CA-C 113.291 0.849 . . . . 0.0 113.291 178.612 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 92.1 m -89.51 -42.41 11.47 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 113.871 1.063 . . . . 0.0 113.871 -172.26 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 604' ' ' SER . . . . . . . . . . . . . 8.5 t -83.68 72.88 10.31 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 113.617 0.969 . . . . 0.0 113.617 -169.293 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 605' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -66.31 -20.76 66.18 Favored 'General case' 0 CA--C 1.544 0.75 0 O-C-N 121.319 -0.863 . . . . 0.0 112.293 172.07 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 606' ' ' ASN . . . . . . . . . . . . . 82.6 m-20 -67.93 -25.44 65.47 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.373 1.069 . . . . 0.0 113.356 175.538 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 607' ' ' SER . . . . . . . . . . . . . 14.1 t -74.12 -16.95 61.0 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.83 1.252 . . . . 0.0 113.872 -179.386 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 608' ' ' SER . . . . . . . . . . . . . 49.5 m . . . . . 0 C--O 1.253 1.286 0 C-N-CA 126.262 1.825 . . . . 0.0 114.348 -178.788 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 533' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.635 0 N-CA-C 111.498 -0.641 . . . . 0.0 111.498 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . -72.12 158.89 53.55 Favored Glycine 0 CA--C 1.539 1.541 0 C-N-CA 124.211 0.91 . . . . 0.0 114.195 178.256 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 535' ' ' SER . . . . . . . . . . . . . 27.0 m -65.7 141.94 58.19 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.792 1.237 . . . . 0.0 112.918 179.764 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 536' ' ' GLU . . . . . . . . . . . . . 70.7 mt-10 -78.52 149.41 33.11 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 124.437 1.095 . . . . 0.0 112.706 175.896 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 537' ' ' PHE . . . . . . . . . . . . . 37.1 p90 -80.87 158.81 25.21 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 124.822 1.249 . . . . 0.0 112.872 175.248 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 22.0 t -70.75 154.29 41.99 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 125.127 1.371 . . . . 0.0 113.546 -178.739 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 539' ' ' ASP . . . . . . . . . . . . . 33.0 p30 -137.16 160.76 38.05 Favored 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 126.411 1.884 . . . . 0.0 112.336 175.915 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 540' ' ' ARG . . . . . . . . . . . . . 27.5 mmm180 -103.49 24.45 11.04 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 125.355 1.462 . . . . 0.0 114.041 -169.082 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 20.4 m -60.7 149.15 36.26 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 125.821 1.648 . . . . 0.0 114.502 -171.64 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 542' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -62.08 -18.14 59.78 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 124.906 1.282 . . . . 0.0 114.17 -177.777 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -59.29 -23.46 62.43 Favored 'General case' 0 N--CA 1.476 0.847 0 O-C-N 120.965 -1.085 . . . . 0.0 113.331 172.013 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 76.1 mt -82.38 -18.27 42.59 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.01 1.324 . . . . 0.0 113.479 172.254 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 35.2 tp10 -91.34 -37.52 13.19 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 124.842 1.257 . . . . 0.0 113.108 -176.397 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 29.6 mm -60.96 -38.09 78.59 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.014 0 CA-C-N 118.828 0.74 . . . . 0.0 111.333 175.691 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 19.8 ptp180 -75.43 -17.8 60.07 Favored 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 113.575 0.954 . . . . 0.0 113.575 -179.676 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -80.88 -9.57 86.13 Favored Glycine 0 CA--C 1.531 1.094 0 C-N-CA 124.77 1.176 . . . . 0.0 114.562 -179.38 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 69.3 mmtt -73.58 143.68 46.31 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 118.522 1.161 . . . . 0.0 112.221 179.581 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 40.6 p90 -159.69 167.21 28.9 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 125.292 1.437 . . . . 0.0 111.886 173.848 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 2.6 m -133.65 141.9 43.0 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.725 0 C-N-CA 125.928 1.691 . . . . 0.0 110.252 171.22 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 7.4 p -76.47 137.22 23.04 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.059 0 O-C-N 121.156 -0.965 . . . . 0.0 112.642 -170.241 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 72.5 t -75.64 125.68 88.23 Favored Pre-proline 0 N--CA 1.472 0.631 0 C-N-CA 124.475 1.11 . . . . 0.0 109.696 171.554 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_endo -78.34 142.67 19.05 Favored 'Trans proline' 0 CA--C 1.539 0.772 0 C-N-CA 122.994 2.463 . . . . 0.0 111.154 173.538 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -63.18 -17.38 62.33 Favored 'General case' 0 N--CA 1.48 1.037 0 O-C-N 121.016 -1.053 . . . . 0.0 113.063 172.36 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 11.3 m -64.93 -27.04 68.58 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 125.782 1.633 . . . . 0.0 112.71 171.481 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 29.2 t -70.6 125.86 27.99 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-N 119.12 0.873 . . . . 0.0 111.907 179.484 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 45.8 tt0 -74.99 -27.14 60.03 Favored 'General case' 0 CA--C 1.55 0.948 0 N-CA-C 112.953 0.723 . . . . 0.0 112.953 176.402 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 20.3 t0 -118.98 -11.37 9.69 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 114.328 1.233 . . . . 0.0 114.328 -172.363 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 79.8 mtp 56.98 34.85 25.58 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 125.976 1.71 . . . . 0.0 113.391 177.566 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -139.63 153.63 47.37 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 115.586 1.699 . . . . 0.0 115.586 -169.579 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 19.9 m-85 -148.18 174.3 12.12 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 128.449 2.699 . . . . 0.0 108.75 169.734 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 7.3 ttpm? -132.15 142.18 49.38 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 124.287 1.035 . . . . 0.0 113.114 -175.059 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 22.3 t -83.11 114.99 56.58 Favored Pre-proline 0 CA--C 1.546 0.819 0 C-N-CA 127.948 2.499 . . . . 0.0 111.03 172.778 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -63.5 -26.38 70.14 Favored 'Trans proline' 0 CA--C 1.538 0.705 0 C-N-CA 123.144 2.563 . . . . 0.0 114.985 173.927 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 89.8 mt -70.35 -55.44 14.51 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.885 0 C-N-CA 124.359 1.063 . . . . 0.0 111.552 -173.581 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 14.3 p -103.54 1.13 31.85 Favored 'General case' 0 CA--C 1.553 1.086 0 C-N-CA 124.79 1.236 . . . . 0.0 113.587 179.725 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 568' ' ' LYS . . . . . . . . . . . . . 29.6 mtpp 60.65 41.45 15.21 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 126.447 1.899 . . . . 0.0 112.448 -179.832 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 77.1 mt-10 -114.23 133.89 55.31 Favored 'General case' 0 N--CA 1.486 1.331 0 N-CA-C 114.208 1.188 . . . . 0.0 114.208 -174.033 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 89.3 m -83.58 118.43 23.8 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 124.051 0.94 . . . . 0.0 111.289 177.573 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 3.5 m -81.95 149.09 4.91 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 124.566 1.146 . . . . 0.0 110.715 168.805 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 82.3 p -133.08 156.36 47.54 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 125.504 1.522 . . . . 0.0 111.273 177.008 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -65.58 140.82 41.39 Favored Glycine 0 CA--C 1.532 1.109 0 N-CA-C 115.043 0.777 . . . . 0.0 115.043 -178.763 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 85.6 t -134.49 131.47 54.39 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 C-N-CA 125.236 1.414 . . . . 0.0 110.492 178.489 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 74.6 t80 -73.89 123.9 25.13 Favored 'General case' 0 CA--C 1.543 0.673 0 N-CA-C 113.573 0.953 . . . . 0.0 113.573 -173.731 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 54.0 t0 -92.64 114.93 27.62 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.214 1.406 . . . . 0.0 109.559 169.233 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -71.32 -27.07 63.13 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 114.062 1.134 . . . . 0.0 114.062 -175.648 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 50.1 mm-40 -88.18 -39.26 14.64 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 124.282 1.033 . . . . 0.0 112.034 -179.591 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 32.4 t -70.84 -35.01 72.24 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 122.964 0.506 . . . . 0.0 112.058 169.99 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 81.35 25.57 54.19 Favored Glycine 0 CA--C 1.534 1.222 0 C-N-CA 125.058 1.313 . . . . 0.0 112.921 -176.482 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 78.8 mm-40 -141.57 152.65 44.25 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.89 1.276 . . . . 0.0 111.876 -170.461 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 84.2 m95 -77.06 138.68 39.7 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 123.862 0.865 . . . . 0.0 110.757 171.584 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 23.4 m -135.24 148.72 28.63 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 C-N-CA 125.415 1.486 . . . . 0.0 113.31 -175.63 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 4.1 m0 -87.63 99.62 12.2 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 126.534 1.934 . . . . 0.0 109.169 169.694 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 32.6 mmtp -68.72 148.44 50.37 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 124.093 0.957 . . . . 0.0 111.881 -178.245 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 64.2 t30 53.63 33.43 16.47 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 125.763 1.625 . . . . 0.0 113.144 179.221 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 90.1 m -116.87 142.83 46.43 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 124.05 0.94 . . . . 0.0 112.645 -171.736 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 11.1 tt -134.94 144.91 33.29 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 C-N-CA 127.71 2.404 . . . . 0.0 110.116 -179.638 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 73.6 tt0 -112.18 136.99 50.89 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 124.683 1.193 . . . . 0.0 110.713 171.272 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 12.7 p -148.56 136.12 13.97 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 C-N-CA 124.421 1.088 . . . . 0.0 110.925 172.268 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 66.0 t30 51.22 37.21 17.87 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 125.038 1.335 . . . . 0.0 113.537 177.761 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 78.1 8.3 87.44 Favored Glycine 0 CA--C 1.537 1.424 0 C-N-CA 124.829 1.204 . . . . 0.0 116.086 -179.279 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -122.94 149.61 44.04 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 125.92 1.688 . . . . 0.0 111.879 -178.147 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 72.6 m-85 -98.69 147.12 25.17 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.633 1.173 . . . . 0.0 113.176 -179.665 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 98.6 m-85 -150.85 168.89 23.1 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 126.551 1.94 . . . . 0.0 110.706 179.664 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 596' ' ' HIS . . . . . . . . . . . . . 22.8 m80 -86.17 144.17 27.62 Favored 'General case' 0 N--CA 1.471 0.605 0 O-C-N 121.288 -0.882 . . . . 0.0 110.08 168.057 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 15.6 m -65.35 -43.54 90.55 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 123.42 0.688 . . . . 0.0 111.969 179.888 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 22.2 p -64.64 -37.69 88.44 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 124.013 0.925 . . . . 0.0 112.966 174.29 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 599' ' ' CYS . . . . . . . . . . . . . 89.6 m -65.86 -59.76 3.54 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.135 0.974 . . . . 0.0 110.965 176.211 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 75.8 t80 -59.13 -38.39 79.52 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.169 0.988 . . . . 0.0 113.481 -175.245 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 76.6 t60 -56.69 -58.3 8.69 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 114.712 1.375 . . . . 0.0 114.712 -173.198 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 15.2 tt0 -98.14 -10.87 23.5 Favored 'General case' 0 CA--C 1.545 0.767 0 N-CA-C 113.637 0.977 . . . . 0.0 113.637 -174.387 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 98.6 m -80.77 -35.42 33.23 Favored 'General case' 0 N--CA 1.485 1.276 0 O-C-N 121.157 -0.964 . . . . 0.0 112.242 179.42 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 604' ' ' SER . . . . . . . . . . . . . 23.3 t -68.11 150.26 48.6 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 123.582 0.753 . . . . 0.0 112.678 178.878 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 605' ' ' GLN . . . . . . . . . . . . . 64.7 tt0 -74.95 83.82 2.23 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 124.153 0.981 . . . . 0.0 110.194 171.813 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 606' ' ' ASN . . . . . . . . . . . . . 81.6 m-20 -67.71 161.01 26.89 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 124.331 1.053 . . . . 0.0 112.424 177.626 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 607' ' ' SER . . . . . . . . . . . . . 22.8 t -139.31 157.85 45.18 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 125.136 1.374 . . . . 0.0 112.364 -175.641 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 608' ' ' SER . . . . . . . . . . . . . 26.9 m . . . . . 0 C--O 1.253 1.267 0 C-N-CA 126.643 1.977 . . . . 0.0 114.052 -175.576 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 533' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.527 0 N-CA-C 111.297 -0.721 . . . . 0.0 111.297 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . -79.72 -8.3 87.82 Favored Glycine 0 CA--C 1.539 1.577 0 N-CA-C 115.864 1.105 . . . . 0.0 115.864 -177.787 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 535' ' ' SER . . . . . . . . . . . . . 9.1 t -152.62 167.61 28.33 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.38 1.472 . . . . 0.0 111.92 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 536' ' ' GLU . . . . . . . . . . . . . 17.1 pt-20 -69.05 155.77 39.79 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 124.764 1.226 . . . . 0.0 113.795 -179.75 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 537' ' ' PHE . . . . . . . . . . . . . 95.5 m-85 -71.31 148.99 46.55 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 124.015 0.926 . . . . 0.0 112.706 175.004 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 77.7 p -76.24 166.06 24.0 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 124.057 0.943 . . . . 0.0 112.624 173.213 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 539' ' ' ASP . . . . . . . . . . . . . 29.3 t0 -78.36 18.52 0.53 Allowed 'General case' 0 CA--C 1.553 1.094 0 C-N-CA 125.495 1.518 . . . . 0.0 114.281 -178.178 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 540' ' ' ARG . . . . . . . . . . . . . 84.3 mtt85 -69.8 153.85 42.78 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 125.25 1.42 . . . . 0.0 112.774 179.487 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 79.6 p -68.82 156.5 38.29 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.887 1.275 . . . . 0.0 112.634 171.571 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 542' ' ' ASN . . . . . . . . . . . . . 30.9 t-20 -72.6 126.76 30.65 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 123.855 0.862 . . . . 0.0 111.715 -177.419 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -113.74 -26.17 8.34 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 125.488 1.515 . . . . 0.0 113.232 172.416 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 63.6 tp -63.77 -40.22 96.16 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.986 0.914 . . . . 0.0 112.59 -177.336 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 63.3 mt-10 -74.32 -18.82 60.65 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 113.425 0.898 . . . . 0.0 113.425 176.917 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 16.7 mm -75.0 -41.76 45.69 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.554 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 168.764 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 7.3 tmm_? -66.37 -36.35 82.65 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 124.111 0.964 . . . . 0.0 111.39 178.919 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -67.15 -6.4 39.02 Favored Glycine 0 CA--C 1.535 1.307 0 C-N-CA 125.704 1.621 . . . . 0.0 116.561 175.801 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt -70.95 134.37 47.14 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-N 119.754 1.777 . . . . 0.0 110.991 171.494 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 41.6 p90 -148.49 166.74 27.29 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 114.443 1.275 . . . . 0.0 114.443 179.697 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -136.91 138.99 45.4 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 C-N-CA 126.776 2.03 . . . . 0.0 109.241 173.722 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 83.8 t -70.48 132.02 33.67 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.994 0 O-C-N 121.043 -1.036 . . . . 0.0 110.908 -174.701 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 87.3 t -71.72 124.87 91.55 Favored Pre-proline 0 CA--C 1.541 0.629 0 C-N-CA 125.331 1.453 . . . . 0.0 109.963 175.268 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 95.5 Cg_endo -78.87 152.21 24.92 Favored 'Trans proline' 0 C--N 1.349 0.567 0 C-N-CA 123.036 2.49 . . . . 0.0 112.19 177.293 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 56.1 mt-10 -62.54 -21.67 65.74 Favored 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 113.215 0.82 . . . . 0.0 113.215 174.001 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 67.8 p -78.61 -11.85 59.99 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 125.89 1.676 . . . . 0.0 113.882 176.104 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 88.5 p -63.7 144.26 57.17 Favored 'General case' 0 N--CA 1.48 1.032 0 CA-C-N 119.242 0.928 . . . . 0.0 112.756 178.062 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 64.5 mt-30 -83.12 118.62 23.7 Favored 'General case' 0 N--CA 1.467 0.404 0 O-C-N 121.449 -0.782 . . . . 0.0 109.287 169.657 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 38.0 m-20 52.15 24.31 2.7 Favored 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 126.415 1.886 . . . . 0.0 115.197 177.47 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 8.9 mtt 54.75 36.21 25.81 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.97 1.308 . . . . 0.0 113.65 -176.453 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -125.03 147.09 49.13 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 114.368 1.247 . . . . 0.0 114.368 -171.491 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 6.5 t80 -155.48 166.4 33.66 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 125.611 1.564 . . . . 0.0 111.084 172.193 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 39.5 ttmt -107.61 148.7 28.97 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 124.907 1.283 . . . . 0.0 114.352 -171.129 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 33.9 t -95.15 110.45 50.28 Favored Pre-proline 0 CA--C 1.543 0.709 0 C-N-CA 128.384 2.674 . . . . 0.0 110.033 167.905 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -64.66 -21.7 65.05 Favored 'Trans proline' 0 CA--C 1.538 0.701 0 C-N-CA 123.037 2.491 . . . . 0.0 115.425 177.649 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 85.0 mt -70.95 -55.46 13.99 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.928 0 C-N-CA 124.025 0.93 . . . . 0.0 110.873 -177.436 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 14.7 p -103.38 0.1 30.83 Favored 'General case' 0 CA--C 1.552 1.052 0 N-CA-C 113.909 1.078 . . . . 0.0 113.909 -178.251 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 568' ' ' LYS . . . . . . . . . . . . 0.332 25.0 pttm 55.32 46.1 24.18 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 127.775 2.43 . . . . 0.0 113.419 -175.481 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 69.6 mm-40 -121.16 150.15 41.72 Favored 'General case' 0 N--CA 1.483 1.176 0 N-CA-C 113.715 1.006 . . . . 0.0 113.715 -175.583 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 89.1 m -93.46 120.79 34.16 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 124.108 0.963 . . . . 0.0 112.303 -176.111 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 2.6 m -79.14 147.16 6.94 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.671 0 C-N-CA 124.215 1.006 . . . . 0.0 110.084 167.326 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 68.6 p -127.53 148.05 50.33 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 124.52 1.128 . . . . 0.0 111.386 175.547 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -70.75 147.39 43.34 Favored Glycine 0 CA--C 1.534 1.26 0 C-N-CA 123.887 0.756 . . . . 0.0 114.001 -178.55 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 85.9 t -133.62 136.37 54.42 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 C-N-CA 125.362 1.465 . . . . 0.0 111.185 177.235 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 63.8 t80 -72.99 118.87 16.47 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 123.478 0.711 . . . . 0.0 112.78 -176.622 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 63.4 t0 -82.68 110.52 17.81 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 168.436 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 57.9 mt-10 -68.12 -25.86 65.51 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 124.692 1.197 . . . . 0.0 113.946 -175.445 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 38.0 tp10 -80.51 -48.44 12.78 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 123.255 0.622 . . . . 0.0 112.229 -176.371 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 99.1 p -78.82 -28.72 44.48 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 123.52 0.728 . . . . 0.0 112.473 173.416 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 82.15 31.13 32.34 Favored Glycine 0 CA--C 1.538 1.474 0 C-N-CA 124.853 1.216 . . . . 0.0 112.606 -177.049 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 56.2 mt-10 -135.34 145.59 47.57 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 118.636 1.218 . . . . 0.0 111.311 -173.963 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 69.9 m95 -77.54 141.02 39.82 Favored 'General case' 0 N--CA 1.466 0.342 0 O-C-N 121.273 -0.892 . . . . 0.0 111.523 177.235 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 17.3 m -135.91 142.59 38.6 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 C-N-CA 125.853 1.661 . . . . 0.0 112.757 -172.93 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 2.0 m0 -88.97 95.36 10.29 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 125.175 1.39 . . . . 0.0 108.019 170.168 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -69.5 160.94 30.51 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 124.291 1.036 . . . . 0.0 111.396 175.007 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 54.61 32.05 16.31 Favored 'General case' 0 CA--C 1.553 1.074 0 C-N-CA 125.04 1.336 . . . . 0.0 112.607 -177.92 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 73.0 m -125.15 146.73 49.36 Favored 'General case' 0 N--CA 1.479 0.984 0 O-C-N 120.978 -1.077 . . . . 0.0 113.564 -169.492 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 18.1 tt -143.19 149.29 18.55 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 C-N-CA 127.085 2.154 . . . . 0.0 110.85 177.924 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 72.6 tt0 -107.89 122.27 46.45 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 124.482 1.113 . . . . 0.0 110.002 168.744 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 2.0 t -144.16 142.11 24.29 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.866 0 C-N-CA 126.332 1.853 . . . . 0.0 109.682 -174.559 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 23.8 t-20 52.27 26.64 4.14 Favored 'General case' 0 CA--C 1.554 1.128 0 C-N-CA 125.526 1.531 . . . . 0.0 114.189 177.537 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 88.42 1.79 80.6 Favored Glycine 0 CA--C 1.54 1.646 0 C-N-CA 125.721 1.629 . . . . 0.0 116.455 -177.786 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 2.7 mptt -128.43 161.18 30.08 Favored 'General case' 0 N--CA 1.479 1.01 0 CA-C-N 119.42 1.61 . . . . 0.0 113.285 -177.823 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 3.6 m-85 -81.78 148.9 28.65 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 115.541 -0.754 . . . . 0.0 111.59 171.746 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 64.2 m-85 -152.87 161.79 42.11 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 126.334 1.853 . . . . 0.0 110.854 -178.106 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 596' ' ' HIS . . . . . 0.413 ' HB2' ' HB2' ' A' ' 599' ' ' CYS . 21.1 m80 -76.97 136.14 38.73 Favored 'General case' 0 N--CA 1.473 0.698 0 N-CA-C 108.259 -1.015 . . . . 0.0 108.259 167.222 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 47.8 p -59.39 -37.45 77.99 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 123.532 0.733 . . . . 0.0 112.375 178.114 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 5.7 p -70.31 -50.51 38.48 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.723 1.209 . . . . 0.0 112.637 175.171 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 599' ' ' CYS . . . . . 0.413 ' HB2' ' HB2' ' A' ' 596' ' ' HIS . 91.4 m -51.51 -52.26 48.34 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.278 1.031 . . . . 0.0 111.423 175.007 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 53.6 t80 -58.51 -52.21 66.61 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 123.483 0.713 . . . . 0.0 111.734 176.605 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 51.6 t-80 -61.81 -38.53 88.48 Favored 'General case' 0 N--CA 1.475 0.824 0 N-CA-C 113.372 0.878 . . . . 0.0 113.372 -176.489 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -71.07 -18.9 62.53 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 113.736 1.014 . . . . 0.0 113.736 175.567 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 88.7 m -101.25 -65.94 0.94 Allowed 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 124.624 1.17 . . . . 0.0 112.132 -177.733 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 604' ' ' SER . . . . . . . . . . . . . 52.0 m 55.22 -49.67 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 129.742 3.217 . . . . 0.0 117.816 -174.488 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 605' ' ' GLN . . . . . . . . . . . . . 59.5 mm-40 -77.8 156.51 30.44 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 126.335 1.854 . . . . 0.0 113.269 -174.518 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 606' ' ' ASN . . . . . . . . . . . . . 67.1 t30 50.47 60.85 3.55 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 126.566 1.946 . . . . 0.0 114.717 168.721 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 607' ' ' SER . . . . . . . . . . . . . 33.4 t -61.88 -34.03 75.27 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 113.754 1.02 . . . . 0.0 113.754 -175.885 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 608' ' ' SER . . . . . . . . . . . . . 22.7 t . . . . . 0 C--O 1.255 1.38 0 C-N-CA 125.655 1.582 . . . . 0.0 112.471 175.457 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 533' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.614 0 N-CA-C 111.75 -0.54 . . . . 0.0 111.75 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . -179.52 81.55 0.06 OUTLIER Glycine 0 CA--C 1.532 1.111 0 C-N-CA 124.317 0.961 . . . . 0.0 112.599 -179.652 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 535' ' ' SER . . . . . . . . . . . . . 36.9 t -66.94 -35.26 79.59 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 124.152 0.981 . . . . 0.0 112.866 -178.641 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 536' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -151.24 145.42 25.36 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.658 1.583 . . . . 0.0 110.591 173.479 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 537' ' ' PHE . . . . . . . . . . . . . 84.9 m-85 -92.83 -2.34 55.99 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 114.902 1.445 . . . . 0.0 114.902 -170.841 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 28.5 t -153.27 144.44 23.04 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 124.666 1.187 . . . . 0.0 112.519 -179.531 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 539' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -152.65 167.25 29.53 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 126.117 1.767 . . . . 0.0 110.514 172.218 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 540' ' ' ARG . . . . . . . . . . . . . 3.7 tpt180 -106.42 11.66 30.59 Favored 'General case' 0 N--CA 1.479 1.007 0 N-CA-C 115.242 1.571 . . . . 0.0 115.242 -171.202 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 40.6 t -70.48 129.64 39.78 Favored 'General case' 0 N--CA 1.473 0.689 0 O-C-N 121.21 -0.931 . . . . 0.0 111.861 177.762 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 542' ' ' ASN . . . . . . . . . . . . . 76.7 m-20 -75.68 -19.63 59.0 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 113.262 0.838 . . . . 0.0 113.262 176.347 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 71.2 tt0 -60.91 -27.91 68.53 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.152 0.981 . . . . 0.0 113.014 -177.15 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 58.4 tp -59.17 -40.84 86.89 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 123.918 0.887 . . . . 0.0 112.348 174.543 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 63.8 mm-40 -75.58 -19.29 59.37 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 125.048 1.339 . . . . 0.0 114.179 -173.804 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 31.1 mm -64.08 -36.51 77.12 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.687 0 C-N-CA 125.065 1.346 . . . . 0.0 112.712 -169.662 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 9.4 ptp180 -70.08 -10.86 60.11 Favored 'General case' 0 N--CA 1.478 0.971 0 N-CA-C 115.756 1.761 . . . . 0.0 115.756 -170.999 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -77.42 -14.56 82.37 Favored Glycine 0 CA--C 1.539 1.542 0 C-N-CA 123.905 0.765 . . . . 0.0 114.838 178.04 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -71.59 147.05 47.99 Favored 'General case' 0 N--CA 1.477 0.911 0 CA-C-N 118.831 1.316 . . . . 0.0 113.472 -177.118 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 51.6 p90 -154.84 162.48 41.09 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 125.603 1.561 . . . . 0.0 111.698 169.554 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -134.74 137.57 50.79 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 C-N-CA 125.899 1.68 . . . . 0.0 110.295 177.709 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 40.7 t -68.29 132.02 33.06 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 C-N-CA 123.671 0.788 . . . . 0.0 109.951 -179.122 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 21.2 t -73.66 123.69 89.61 Favored Pre-proline 0 N--CA 1.474 0.745 0 C-N-CA 124.144 0.978 . . . . 0.0 109.131 171.075 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_endo -70.59 146.32 54.76 Favored 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 122.5 2.133 . . . . 0.0 111.699 178.045 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -62.98 -18.77 63.64 Favored 'General case' 0 N--CA 1.474 0.75 0 O-C-N 121.367 -0.833 . . . . 0.0 113.157 174.184 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 18.7 m -58.53 -32.76 69.16 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 124.943 1.297 . . . . 0.0 111.726 169.296 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 19.7 t -81.73 101.57 10.19 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.623 0.769 . . . . 0.0 111.372 172.079 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 93.0 mt-30 -71.86 -30.66 65.67 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 123.289 0.636 . . . . 0.0 112.242 175.071 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 76.5 m-20 -91.12 -19.7 22.83 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.152 0.981 . . . . 0.0 113.456 -177.348 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 6.2 mtt 55.76 33.08 20.72 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 125.815 1.646 . . . . 0.0 114.95 178.779 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -133.25 136.61 45.66 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.027 0.931 . . . . 0.0 113.24 -175.317 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -143.61 161.1 39.38 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 126.329 1.852 . . . . 0.0 110.753 175.53 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 23.7 tptt -94.75 157.85 15.77 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 124.442 1.097 . . . . 0.0 113.626 -173.957 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 15.2 t -109.98 96.45 25.08 Favored Pre-proline 0 CA--C 1.547 0.838 0 C-N-CA 126.755 2.022 . . . . 0.0 107.566 165.659 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -60.06 -17.61 46.1 Favored 'Trans proline' 0 CA--C 1.548 1.183 0 C-N-CA 122.586 2.191 . . . . 0.0 115.342 177.325 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 73.0 mt -72.58 -58.25 5.41 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.892 0 C-N-CA 124.81 1.244 . . . . 0.0 111.076 -179.942 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 13.7 p -101.93 1.64 37.04 Favored 'General case' 0 CA--C 1.553 1.074 0 N-CA-C 113.964 1.098 . . . . 0.0 113.964 -179.24 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 568' ' ' LYS . . . . . . . . . . . . . 53.6 mtmt 62.37 36.38 14.45 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 128.125 2.57 . . . . 0.0 113.322 -179.033 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 51.2 mm-40 -100.71 173.03 6.72 Favored 'General case' 0 N--CA 1.481 1.124 0 O-C-N 121.731 -0.606 . . . . 0.0 112.539 -177.796 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 59.2 m -118.26 120.97 39.25 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 124.542 1.137 . . . . 0.0 110.71 172.81 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 1.5 m -83.28 121.51 36.26 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.726 0 C-N-CA 124.837 1.255 . . . . 0.0 109.667 169.169 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 47.6 p -106.17 141.72 37.06 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 124.822 1.249 . . . . 0.0 111.263 175.002 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -65.91 148.27 50.88 Favored Glycine 0 CA--C 1.528 0.873 0 C-N-CA 124.099 0.857 . . . . 0.0 113.438 179.241 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 65.0 t -131.21 129.01 62.49 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 C-N-CA 125.743 1.617 . . . . 0.0 111.25 179.909 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 35.1 t80 -74.74 124.38 26.66 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 113.004 0.742 . . . . 0.0 113.004 -175.144 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 64.0 t0 -90.61 106.37 18.46 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.92 1.288 . . . . 0.0 109.156 168.609 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 57.7 mt-10 -66.54 -26.38 67.11 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.051 0.94 . . . . 0.0 113.427 -178.324 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -81.82 -44.72 16.55 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 124.38 1.072 . . . . 0.0 111.798 -178.642 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 53.9 m -77.37 -26.88 52.33 Favored 'General case' 0 N--CA 1.476 0.859 0 N-CA-C 112.946 0.721 . . . . 0.0 112.946 174.318 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 76.99 29.05 57.66 Favored Glycine 0 CA--C 1.539 1.561 0 C-N-CA 125.052 1.311 . . . . 0.0 113.52 -176.445 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 77.4 mm-40 -139.24 150.91 46.05 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 125.839 1.656 . . . . 0.0 111.164 -173.256 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 67.7 m95 -84.73 146.07 27.6 Favored 'General case' 0 N--CA 1.468 0.427 0 O-C-N 121.396 -0.815 . . . . 0.0 110.852 173.468 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 27.9 m -133.49 151.75 33.98 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.977 0 C-N-CA 125.838 1.655 . . . . 0.0 113.678 -178.382 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 3.3 m0 -105.22 107.89 19.12 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 127.241 2.217 . . . . 0.0 107.128 171.606 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -86.24 149.62 24.95 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 125.013 1.325 . . . . 0.0 112.594 -174.791 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 65.0 t30 50.8 32.57 7.31 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 126.106 1.762 . . . . 0.0 113.008 -169.576 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 98.0 m -113.81 146.57 39.76 Favored 'General case' 0 N--CA 1.476 0.833 0 O-C-N 120.92 -1.113 . . . . 0.0 111.993 -172.685 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 9.3 tt -127.55 137.52 57.44 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 C-N-CA 126.779 2.031 . . . . 0.0 110.783 175.101 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -94.98 130.86 41.46 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 125.302 1.441 . . . . 0.0 110.185 169.484 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 12.7 p -150.84 132.42 5.15 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 C-N-CA 124.813 1.245 . . . . 0.0 111.254 174.472 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 77.3 m-20 52.04 40.06 27.65 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 124.935 1.294 . . . . 0.0 114.484 174.504 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 77.4 10.24 86.36 Favored Glycine 0 CA--C 1.541 1.674 0 C-N-CA 125.39 1.472 . . . . 0.0 115.257 -178.866 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 48.6 mttp -133.2 171.65 13.73 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 126.885 2.074 . . . . 0.0 111.03 -170.837 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 84.6 m-85 -121.98 153.09 39.0 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 124.373 1.069 . . . . 0.0 113.673 -176.986 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 23.8 m-85 -151.87 164.82 36.29 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 126.986 2.115 . . . . 0.0 109.941 175.921 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 596' ' ' HIS . . . . . . . . . . . . . 25.5 m80 -77.76 138.67 39.14 Favored 'General case' 0 N--CA 1.468 0.46 0 N-CA-C 107.407 -1.331 . . . . 0.0 107.407 165.906 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 5.5 t -64.36 -39.07 93.14 Favored 'General case' 0 CA--C 1.539 0.539 0 O-C-N 121.597 -0.69 . . . . 0.0 111.952 -177.454 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 18.3 p -66.3 -37.28 85.05 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 124.735 1.214 . . . . 0.0 113.61 173.354 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 599' ' ' CYS . . . . . . . . . . . . . 72.3 m -63.88 -54.83 28.67 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 123.797 0.839 . . . . 0.0 110.644 173.337 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 75.9 t80 -57.97 -37.51 74.32 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 125.046 1.339 . . . . 0.0 112.665 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 11.8 t-160 -60.59 -35.52 76.3 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.231 1.012 . . . . 0.0 113.19 176.254 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -79.67 -33.35 41.28 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 113.65 0.982 . . . . 0.0 113.65 176.328 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 69.8 p -89.72 -25.89 20.94 Favored 'General case' 0 N--CA 1.48 1.032 0 N-CA-C 114.645 1.35 . . . . 0.0 114.645 -174.922 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 604' ' ' SER . . . . . . . . . . . . . 33.9 t -62.81 122.08 15.05 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 123.979 0.912 . . . . 0.0 112.064 -177.45 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 605' ' ' GLN . . . . . . . . . . . . . 42.4 mt-30 -148.79 164.09 35.44 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 126.981 2.112 . . . . 0.0 110.938 -176.307 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 606' ' ' ASN . . . . . . . . . . . . . 18.4 m120 55.71 43.87 27.25 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 125.271 1.428 . . . . 0.0 113.202 178.562 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 607' ' ' SER . . . . . . . . . . . . . 12.8 m -68.75 -9.84 53.04 Favored 'General case' 0 N--CA 1.478 0.942 0 N-CA-C 115.775 1.769 . . . . 0.0 115.775 -170.658 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 608' ' ' SER . . . . . . . . . . . . . 38.4 m . . . . . 0 C--O 1.252 1.232 0 C-N-CA 126.506 1.922 . . . . 0.0 114.073 -176.841 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 533' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.521 0 N-CA-C 111.063 -0.815 . . . . 0.0 111.063 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . -84.52 -25.83 41.39 Favored Glycine 0 CA--C 1.538 1.486 0 C-N-CA 124.42 1.01 . . . . 0.0 115.286 -178.934 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 535' ' ' SER . . . . . . . . . . . . . 94.6 p -157.0 0.83 0.12 Allowed 'General case' 0 N--CA 1.483 1.186 0 N-CA-C 115.575 1.694 . . . . 0.0 115.575 -174.499 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 536' ' ' GLU . . . . . . . . . . . . . 54.3 mp0 -69.28 -20.57 63.91 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.241 1.416 . . . . 0.0 113.759 -175.667 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 537' ' ' PHE . . . . . . . . . . . . . 81.0 m-85 -133.57 139.07 46.34 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.837 1.655 . . . . 0.0 111.446 -177.951 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 94.7 p -163.85 -162.64 0.72 Allowed 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 126.054 1.742 . . . . 0.0 110.099 -174.291 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 539' ' ' ASP . . . . . . . . . . . . . 66.6 m-20 -68.6 1.34 3.23 Favored 'General case' 0 CA--C 1.554 1.102 0 N-CA-C 114.167 1.173 . . . . 0.0 114.167 169.771 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 540' ' ' ARG . . . . . . . . . . . . . 52.6 ptt85 -56.52 155.88 6.77 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 125.611 1.565 . . . . 0.0 114.214 176.997 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 94.3 p -81.09 170.45 16.17 Favored 'General case' 0 C--O 1.24 0.596 0 C-N-CA 124.532 1.133 . . . . 0.0 111.794 169.114 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 542' ' ' ASN . . . . . . . . . . . . . 76.6 m-20 -87.1 -3.55 59.08 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 124.15 0.98 . . . . 0.0 113.052 169.947 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -62.33 -27.96 69.41 Favored 'General case' 0 N--CA 1.478 0.958 0 O-C-N 120.63 -1.294 . . . . 0.0 113.181 -174.211 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 80.5 mt -62.44 -29.45 70.52 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.665 1.186 . . . . 0.0 112.443 175.637 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 56.7 mt-10 -80.95 -19.33 44.41 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.556 1.143 . . . . 0.0 112.591 -177.978 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 14.6 mm -67.26 -31.93 55.26 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 C-N-CA 124.403 1.081 . . . . 0.0 111.232 176.721 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 39.3 mmt180 -58.19 -25.5 61.64 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 124.24 1.016 . . . . 0.0 112.799 171.856 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -79.88 -7.62 88.36 Favored Glycine 0 CA--C 1.536 1.394 0 C-N-CA 125.966 1.746 . . . . 0.0 115.013 -179.983 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 8.9 mmpt? -66.7 147.02 53.83 Favored 'General case' 0 N--CA 1.482 1.131 0 CA-C-N 119.811 1.805 . . . . 0.0 111.091 171.793 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 52.5 p90 -151.51 162.46 40.92 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.549 0.739 . . . . 0.0 112.787 171.193 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 1.6 m -130.44 134.69 61.94 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.926 0 C-N-CA 125.853 1.661 . . . . 0.0 109.74 173.075 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 10.0 p -67.8 138.01 23.5 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 O-C-N 121.616 -0.678 . . . . 0.0 111.731 -175.75 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 57.6 t -87.94 112.09 46.87 Favored Pre-proline 0 CA--C 1.544 0.744 0 C-N-CA 125.459 1.504 . . . . 0.0 108.941 170.19 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 67.5 Cg_endo -76.66 156.33 35.67 Favored 'Trans proline' 0 C--N 1.348 0.525 0 C-N-CA 122.62 2.213 . . . . 0.0 111.664 176.045 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 46.7 tt0 -58.02 -33.49 69.01 Favored 'General case' 0 CA--C 1.54 0.59 0 O-C-N 121.331 -0.856 . . . . 0.0 112.282 174.125 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 15.2 m -59.04 -25.98 64.18 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 125.463 1.505 . . . . 0.0 113.719 175.299 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 10.0 t -69.12 -23.61 64.0 Favored 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 113.092 0.775 . . . . 0.0 113.092 177.229 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 30.5 mt-30 59.35 -62.37 0.05 OUTLIER 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 129.211 3.005 . . . . 0.0 115.915 176.251 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 65.9 m-20 -82.21 -14.14 56.03 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 125.733 1.613 . . . . 0.0 113.374 -175.804 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 11.1 mtt 56.96 25.68 10.91 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 126.398 1.879 . . . . 0.0 114.976 179.582 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -131.42 144.75 51.42 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.265 1.026 . . . . 0.0 113.265 -171.748 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 4.5 t80 -153.84 -178.45 7.06 Favored 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 125.899 1.68 . . . . 0.0 109.668 173.131 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 5.2 tmmm? -137.05 134.17 36.25 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 125.027 1.331 . . . . 0.0 112.635 -178.695 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 30.9 t -69.55 117.17 50.4 Favored Pre-proline 0 CA--C 1.543 0.707 0 C-N-CA 126.681 1.993 . . . . 0.0 111.007 174.086 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_exo -65.11 -26.59 57.56 Favored 'Trans proline' 0 CA--C 1.542 0.885 0 C-N-CA 123.047 2.498 . . . . 0.0 114.646 175.739 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 80.6 mt -71.52 -57.46 7.44 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 C-N-CA 124.622 1.169 . . . . 0.0 111.418 -173.325 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 16.9 p -98.54 -1.86 40.1 Favored 'General case' 0 CA--C 1.549 0.932 0 N-CA-C 113.61 0.967 . . . . 0.0 113.61 179.276 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 568' ' ' LYS . . . . . . . . . . . . . 95.7 mttt 60.35 46.7 9.73 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 126.621 1.968 . . . . 0.0 112.778 -177.781 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 73.2 mm-40 -125.85 139.08 53.78 Favored 'General case' 0 N--CA 1.483 1.176 0 N-CA-C 115.481 1.66 . . . . 0.0 115.481 -174.24 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 24.4 m -69.66 138.51 53.07 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.734 1.214 . . . . 0.0 113.127 -179.109 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -112.73 140.07 34.5 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 C-N-CA 126.639 1.976 . . . . 0.0 109.904 167.841 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 44.4 p -130.42 144.03 51.14 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 125.377 1.471 . . . . 0.0 110.961 178.452 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -65.95 144.27 46.3 Favored Glycine 0 CA--C 1.53 1.006 0 C-N-CA 123.773 0.701 . . . . 0.0 114.093 -179.118 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 19.2 m -128.92 149.22 33.43 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 C-N-CA 125.68 1.592 . . . . 0.0 111.742 174.914 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 62.8 t80 -74.25 140.42 44.99 Favored 'General case' 0 CA--C 1.542 0.663 0 O-C-N 121.311 -0.868 . . . . 0.0 113.08 -175.94 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 21.1 t0 -115.81 118.53 33.28 Favored 'General case' 0 C--O 1.236 0.342 0 C-N-CA 126.776 2.031 . . . . 0.0 110.82 171.186 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 23.6 mp0 -74.27 -25.97 59.92 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 124.183 0.993 . . . . 0.0 113.383 -177.389 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 37.2 tp10 -74.48 -49.13 23.44 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 124.421 1.088 . . . . 0.0 112.195 -179.459 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 20.5 m -77.18 -31.71 55.6 Favored 'General case' 0 N--CA 1.476 0.833 0 O-C-N 121.739 -0.601 . . . . 0.0 111.924 172.637 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 76.38 30.48 56.7 Favored Glycine 0 CA--C 1.535 1.309 0 C-N-CA 123.506 0.574 . . . . 0.0 111.878 -170.11 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 79.9 mm-40 -130.95 175.92 8.67 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 126.253 1.821 . . . . 0.0 111.085 -174.166 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 62.4 m95 -100.15 149.77 23.19 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 123.969 0.908 . . . . 0.0 111.026 172.306 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 13.0 m -140.84 147.05 23.14 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 C-N-CA 125.94 1.696 . . . . 0.0 112.871 -172.311 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 4.1 m0 -97.64 106.64 18.99 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 125.905 1.682 . . . . 0.0 107.891 169.057 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 42.8 mtmt -81.96 153.22 26.37 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 124.133 0.973 . . . . 0.0 112.282 -179.456 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 54.25 33.65 18.66 Favored 'General case' 0 CA--C 1.554 1.101 0 C-N-CA 125.646 1.578 . . . . 0.0 111.601 -174.825 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 65.5 m -130.03 150.86 51.12 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 125.307 1.443 . . . . 0.0 112.293 -169.407 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 9.9 tt -140.24 146.32 24.82 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.653 0 C-N-CA 128.508 2.723 . . . . 0.0 110.108 -179.667 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 67.3 tt0 -113.77 132.87 55.69 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 125.35 1.46 . . . . 0.0 110.689 170.272 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 9.4 p -157.19 143.71 9.71 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 C-N-CA 124.479 1.112 . . . . 0.0 111.411 176.378 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 9.4 t-20 52.78 32.9 13.0 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 125.285 1.434 . . . . 0.0 114.421 178.223 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 76.05 9.76 85.33 Favored Glycine 0 CA--C 1.538 1.489 0 C-N-CA 124.698 1.142 . . . . 0.0 115.563 -177.511 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 99.6 mttt -122.13 152.45 39.88 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 126.013 1.725 . . . . 0.0 111.493 -179.983 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 79.0 m-85 -98.65 150.62 21.57 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 124.084 0.954 . . . . 0.0 112.751 170.304 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 93.4 m-85 -151.44 161.51 42.56 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 125.959 1.704 . . . . 0.0 110.1 -179.681 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 596' ' ' HIS . . . . . 0.437 ' HB2' ' HB2' ' A' ' 599' ' ' CYS . 28.6 m80 -75.71 141.89 42.58 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 167.027 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 50.3 p -61.26 -42.71 99.1 Favored 'General case' 0 N--CA 1.47 0.525 0 C-N-CA 123.592 0.757 . . . . 0.0 112.214 -179.321 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 2.7 p -68.35 -42.0 79.85 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 124.42 1.088 . . . . 0.0 112.791 175.457 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 599' ' ' CYS . . . . . 0.437 ' HB2' ' HB2' ' A' ' 596' ' ' HIS . 69.4 m -58.68 -59.2 5.79 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.192 0.997 . . . . 0.0 110.894 175.068 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 79.2 t80 -57.76 -43.25 85.35 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.375 1.07 . . . . 0.0 112.648 -177.912 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 82.5 t60 -58.13 -39.49 78.85 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 179.855 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 37.9 tp10 -90.45 -25.26 20.43 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 114.241 1.2 . . . . 0.0 114.241 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 28.3 m -110.04 -26.11 9.88 Favored 'General case' 0 N--CA 1.482 1.164 0 N-CA-C 115.766 1.765 . . . . 0.0 115.766 -166.924 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 604' ' ' SER . . . . . . . . . . . . . 71.2 p -56.23 -72.09 0.08 Allowed 'General case' 0 N--CA 1.481 1.098 0 N-CA-C 115.134 1.531 . . . . 0.0 115.134 -168.907 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 605' ' ' GLN . . . . . . . . . . . . . 37.0 tt0 40.66 -88.93 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 128.532 2.733 . . . . 0.0 116.2 178.689 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 606' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -149.51 147.9 28.75 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 126.281 1.833 . . . . 0.0 112.143 -176.423 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 607' ' ' SER . . . . . . . . . . . . . 33.3 t -73.03 -35.79 66.82 Favored 'General case' 0 N--CA 1.479 0.982 0 N-CA-C 113.349 0.87 . . . . 0.0 113.349 176.978 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 608' ' ' SER . . . . . . . . . . . . . 64.6 p . . . . . 0 C--O 1.252 1.235 0 C-N-CA 126.285 1.834 . . . . 0.0 113.252 -177.7 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 533' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.614 0 N-CA-C 111.458 -0.657 . . . . 0.0 111.458 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 81.83 23.52 57.55 Favored Glycine 0 CA--C 1.537 1.454 0 C-N-CA 123.977 0.798 . . . . 0.0 113.258 -172.36 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 535' ' ' SER . . . . . . . . . . . . . 79.5 p -145.75 4.29 0.99 Allowed 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 126.119 1.768 . . . . 0.0 113.945 -171.186 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 536' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -64.89 176.29 1.26 Allowed 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 126.311 1.844 . . . . 0.0 113.2 173.095 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 537' ' ' PHE . . . . . . . . . . . . . 40.8 p90 -61.99 -26.95 68.53 Favored 'General case' 0 CA--C 1.546 0.806 0 N-CA-C 113.973 1.101 . . . . 0.0 113.973 177.737 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 65.3 p -78.86 157.81 28.24 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 125.497 1.519 . . . . 0.0 112.913 177.803 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 539' ' ' ASP . . . . . . . . . . . . . 63.8 m-20 -77.65 56.93 1.53 Allowed 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 125.379 1.472 . . . . 0.0 113.732 -173.472 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 540' ' ' ARG . . . . . . . . . . . . . 55.4 mtp180 -72.16 28.42 0.05 Allowed 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 126.322 1.849 . . . . 0.0 114.733 178.914 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 20.8 t -73.62 -175.0 1.88 Allowed 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 125.552 1.541 . . . . 0.0 111.31 170.928 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 542' ' ' ASN . . . . . . . . . . . . . 76.2 m-20 -55.38 -21.84 17.16 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.017 1.327 . . . . 0.0 113.71 176.22 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 85.7 mt-10 -56.12 -26.76 51.32 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 125.08 1.352 . . . . 0.0 113.465 172.154 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 50.2 tp -69.56 -31.6 69.88 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 123.997 0.919 . . . . 0.0 112.689 175.04 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 69.3 mm-40 -75.51 -24.7 56.87 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.468 1.107 . . . . 0.0 112.824 177.728 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 22.7 mm -58.12 -37.02 59.65 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.829 0 C-N-CA 124.391 1.077 . . . . 0.0 111.45 177.513 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 30.7 mmm-85 -64.59 -29.93 70.95 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.739 1.216 . . . . 0.0 112.693 178.564 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -82.54 -7.29 87.7 Favored Glycine 0 CA--C 1.535 1.282 0 C-N-CA 125.056 1.312 . . . . 0.0 115.133 179.9 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -69.99 145.85 51.51 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 118.904 1.352 . . . . 0.0 111.829 176.806 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 38.6 p90 -153.39 166.92 31.15 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 125.032 1.333 . . . . 0.0 112.773 175.296 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 2.4 m -131.1 138.72 52.75 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.5 0 C-N-CA 125.733 1.613 . . . . 0.0 110.136 169.774 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 9.9 p -69.36 136.41 26.32 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 O-C-N 121.319 -0.863 . . . . 0.0 111.623 -176.993 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 51.1 t -76.31 123.89 88.0 Favored Pre-proline 0 CA--C 1.543 0.706 0 C-N-CA 124.805 1.242 . . . . 0.0 109.586 177.352 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -74.9 150.2 38.33 Favored 'Trans proline' 0 CA--C 1.543 0.939 0 C-N-CA 122.993 2.462 . . . . 0.0 111.028 175.998 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 50.3 mt-10 -65.09 -19.29 65.92 Favored 'General case' 0 CA--C 1.549 0.926 0 N-CA-C 113.479 0.918 . . . . 0.0 113.479 177.723 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 68.2 p -68.71 -24.92 64.54 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 124.216 1.006 . . . . 0.0 113.153 170.334 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 17.5 t -79.36 76.55 5.93 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-O 122.371 1.081 . . . . 0.0 110.299 169.791 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 62.6 tt0 -60.33 -34.45 73.84 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.356 1.062 . . . . 0.0 112.956 -174.496 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 69.4 m-20 -87.51 -6.59 58.3 Favored 'General case' 0 CA--C 1.551 0.981 0 C-N-CA 124.954 1.302 . . . . 0.0 113.74 175.114 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 9.0 mtt 52.24 38.44 24.66 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 126.785 2.034 . . . . 0.0 114.188 -178.116 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -128.26 143.43 51.03 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 114.244 1.201 . . . . 0.0 114.244 -173.168 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -143.36 176.54 9.08 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 126.487 1.915 . . . . 0.0 109.322 172.826 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 563' ' ' LYS . . . . . . . . . . . . 0.255 0.0 OUTLIER -141.76 148.16 38.52 Favored 'General case' 0 N--CA 1.477 0.888 0 N-CA-C 114.767 1.395 . . . . 0.0 114.767 175.891 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 12.0 t -79.32 116.85 63.49 Favored Pre-proline 0 CA--C 1.542 0.636 0 C-N-CA 126.765 2.026 . . . . 0.0 111.006 173.451 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_endo -72.51 -18.15 26.12 Favored 'Trans proline' 0 CA--C 1.545 1.073 0 C-N-CA 122.719 2.279 . . . . 0.0 113.612 174.782 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 90.7 mt -71.49 -55.22 14.47 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.9 0 C-N-CA 124.514 1.125 . . . . 0.0 110.747 -178.442 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 13.9 p -103.61 2.52 33.42 Favored 'General case' 0 CA--C 1.552 1.028 0 N-CA-C 114.137 1.162 . . . . 0.0 114.137 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 568' ' ' LYS . . . . . . . . . . . . 0.308 11.9 ptmm? 54.52 46.61 24.52 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 127.04 2.136 . . . . 0.0 113.82 -177.045 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 69.2 mm-40 -124.81 143.33 50.87 Favored 'General case' 0 N--CA 1.482 1.143 0 N-CA-C 114.835 1.42 . . . . 0.0 114.835 -176.108 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 73.9 m -78.06 145.66 35.72 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 124.241 1.017 . . . . 0.0 112.749 -178.589 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -119.61 131.7 71.43 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.892 0 C-N-CA 127.014 2.126 . . . . 0.0 109.752 168.305 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 38.9 p -111.86 147.02 36.67 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 125.064 1.345 . . . . 0.0 111.753 178.277 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -71.02 147.57 43.16 Favored Glycine 0 CA--C 1.532 1.101 0 C-N-CA 124.933 1.254 . . . . 0.0 113.743 178.621 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 60.9 t -139.47 132.49 36.93 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 C-N-CA 124.56 1.144 . . . . 0.0 111.083 -176.465 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 68.5 t80 -70.12 112.1 6.24 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 118.706 0.684 . . . . 0.0 111.522 179.478 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 23.2 t0 -81.8 112.02 18.57 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 123.331 0.653 . . . . 0.0 109.559 169.39 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 53.6 mt-10 -69.43 -19.31 63.79 Favored 'General case' 0 CA--C 1.546 0.812 0 N-CA-C 113.913 1.079 . . . . 0.0 113.913 178.836 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 33.2 tp10 -77.38 -51.41 10.86 Favored 'General case' 0 CA--C 1.543 0.71 0 O-C-N 121.366 -0.834 . . . . 0.0 112.811 178.898 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 32.2 t -76.06 -33.42 59.58 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 124.309 1.044 . . . . 0.0 112.686 172.318 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 86.09 31.18 20.84 Favored Glycine 0 CA--C 1.531 1.064 0 C-N-CA 125.038 1.304 . . . . 0.0 113.63 -176.761 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 74.1 mm-40 -142.31 151.66 42.19 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 125.504 1.522 . . . . 0.0 111.825 -172.459 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 82.5 m95 -75.84 134.4 40.36 Favored 'General case' 0 N--CA 1.468 0.437 0 O-C-N 121.653 -0.654 . . . . 0.0 111.7 172.521 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 17.0 m -135.05 143.0 38.5 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.559 0 C-N-CA 125.414 1.486 . . . . 0.0 113.327 -171.844 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 3.7 m0 -91.03 100.95 13.72 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 126.287 1.835 . . . . 0.0 107.857 169.288 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -73.98 153.85 39.56 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 124.169 0.988 . . . . 0.0 111.66 -179.68 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 54.63 36.75 26.76 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 125.03 1.332 . . . . 0.0 112.047 179.409 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 85.0 m -129.83 148.19 51.68 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 125.173 1.389 . . . . 0.0 112.113 -170.328 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 588' ' ' ILE . . . . . 0.406 HG23 ' HB2' ' A' ' 595' ' ' PHE . 15.4 tt -145.84 146.3 19.46 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 C-N-CA 126.912 2.085 . . . . 0.0 111.503 -178.388 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 8.9 tm-20 -107.54 145.6 32.94 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.852 1.261 . . . . 0.0 111.172 166.343 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 1.2 t -159.32 144.58 6.56 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 C-N-CA 126.196 1.798 . . . . 0.0 109.765 171.589 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 10.6 t-20 54.99 29.87 13.09 Favored 'General case' 0 CA--C 1.554 1.133 0 N-CA-C 114.17 1.174 . . . . 0.0 114.17 175.036 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 76.73 14.06 82.91 Favored Glycine 0 CA--C 1.535 1.284 0 C-N-CA 124.618 1.104 . . . . 0.0 115.066 -176.45 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 51.1 mttp -131.31 146.83 52.46 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 126.088 1.755 . . . . 0.0 110.873 -171.337 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 57.4 m-85 -102.35 147.85 26.2 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 123.857 0.863 . . . . 0.0 112.838 -178.329 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 595' ' ' PHE . . . . . 0.406 ' HB2' HG23 ' A' ' 588' ' ' ILE . 89.8 m-85 -153.19 164.46 38.02 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.914 1.686 . . . . 0.0 111.574 -169.879 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 596' ' ' HIS . . . . . 0.43 ' HB2' ' HB2' ' A' ' 599' ' ' CYS . 17.6 m80 -77.83 140.72 39.4 Favored 'General case' 0 N--CA 1.473 0.694 0 O-C-N 121.023 -1.048 . . . . 0.0 108.706 166.204 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 78.3 p -58.4 -42.24 86.69 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 123.657 0.783 . . . . 0.0 112.234 178.304 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 22.8 p -67.92 -47.71 67.99 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 125.533 1.533 . . . . 0.0 113.213 174.854 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 599' ' ' CYS . . . . . 0.43 ' HB2' ' HB2' ' A' ' 596' ' ' HIS . 86.4 m -60.65 -50.63 72.75 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 123.436 0.694 . . . . 0.0 111.493 179.732 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 88.2 t80 -56.07 -45.22 79.39 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 123.291 0.637 . . . . 0.0 112.135 178.227 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 22.7 t-160 -63.67 -46.56 84.99 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 112.939 0.718 . . . . 0.0 112.939 177.736 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 14.9 tm-20 -70.42 -33.4 71.3 Favored 'General case' 0 CA--C 1.543 0.702 0 O-C-N 121.502 -0.749 . . . . 0.0 112.649 -179.642 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 96.0 m -74.7 -37.53 62.59 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.619 1.168 . . . . 0.0 112.06 177.823 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 604' ' ' SER . . . . . . . . . . . . . 38.0 m -78.06 58.95 2.09 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 125.247 1.419 . . . . 0.0 111.5 174.814 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 605' ' ' GLN . . . . . . . . . . . . . 2.8 pt20 -70.4 75.48 0.55 Allowed 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 126.233 1.813 . . . . 0.0 113.817 -170.318 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 606' ' ' ASN . . . . . . . . . . . . . 65.4 m-20 58.5 31.4 20.97 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 126.529 1.932 . . . . 0.0 114.283 177.231 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 607' ' ' SER . . . . . . . . . . . . . 65.1 p -67.49 154.24 41.85 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 124.904 1.281 . . . . 0.0 113.073 175.056 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 608' ' ' SER . . . . . . . . . . . . . 21.1 t . . . . . 0 C--O 1.253 1.285 0 C-N-CA 125.662 1.585 . . . . 0.0 112.936 -179.255 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 533' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.551 0 N-CA-C 111.842 -0.503 . . . . 0.0 111.842 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 173.82 -162.95 33.88 Favored Glycine 0 CA--C 1.535 1.305 0 C-N-CA 124.71 1.147 . . . . 0.0 113.604 179.485 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 535' ' ' SER . . . . . . . . . . . . . 77.2 p -69.92 174.85 4.84 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.846 1.258 . . . . 0.0 112.62 170.917 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 536' ' ' GLU . . . . . . . . . . . . . 15.0 mp0 -68.24 136.39 53.46 Favored 'General case' 0 CA--C 1.547 0.852 0 O-C-N 120.887 -1.133 . . . . 0.0 113.096 -179.563 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 537' ' ' PHE . . . . . . . . . . . . . 75.7 m-85 -133.61 16.4 3.98 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 125.449 1.5 . . . . 0.0 113.262 177.021 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 88.8 p -153.49 163.73 39.45 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 124.767 1.227 . . . . 0.0 113.288 -172.234 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 539' ' ' ASP . . . . . . . . . . . . . 31.7 m-20 -131.39 149.46 52.53 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 126.948 2.099 . . . . 0.0 109.986 173.027 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 540' ' ' ARG . . . . . . . . . . . . . 13.3 tpt180 -78.3 52.29 1.11 Allowed 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 124.407 1.083 . . . . 0.0 112.801 -178.906 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 49.7 m -68.94 136.2 52.17 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 124.869 1.268 . . . . 0.0 111.282 174.728 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 542' ' ' ASN . . . . . . . . . . . . . 13.3 p-10 -60.58 -26.4 66.92 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 123.955 0.902 . . . . 0.0 113.372 -177.74 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 76.2 mt-10 -62.08 -30.52 71.06 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 125.103 1.361 . . . . 0.0 113.137 176.951 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 63.2 mt -82.03 -26.46 33.76 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.125 0.97 . . . . 0.0 112.274 179.087 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -65.77 -26.43 67.71 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 124.539 1.136 . . . . 0.0 112.51 -179.874 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 14.1 mm -54.43 -34.97 29.64 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 C-N-CA 126.057 1.743 . . . . 0.0 112.451 -177.545 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 32.8 ttm180 -61.33 -21.48 64.04 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 125.158 1.383 . . . . 0.0 113.924 178.051 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -71.85 -12.74 75.04 Favored Glycine 0 CA--C 1.539 1.566 0 N-CA-C 115.289 0.876 . . . . 0.0 115.289 177.271 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -70.96 147.91 48.22 Favored 'General case' 0 N--CA 1.478 0.944 0 CA-C-N 118.965 1.383 . . . . 0.0 112.129 177.844 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 46.8 p90 -152.59 165.81 34.01 Favored 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 114.008 1.114 . . . . 0.0 114.008 176.127 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 1.1 m -135.67 139.5 46.22 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.035 0 C-N-CA 126.757 2.023 . . . . 0.0 110.484 174.994 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 55.5 t -69.71 133.09 32.46 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.298 0 O-C-N 120.889 -1.132 . . . . 0.0 111.662 -176.021 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 95.0 t -69.37 124.17 89.91 Favored Pre-proline 0 N--CA 1.476 0.837 0 C-N-CA 124.725 1.21 . . . . 0.0 109.035 170.263 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 93.7 Cg_endo -78.35 143.48 19.68 Favored 'Trans proline' 0 CA--C 1.536 0.596 0 C-N-CA 123.152 2.568 . . . . 0.0 111.977 174.477 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -61.55 -24.76 66.86 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.08 0.952 . . . . 0.0 113.248 -179.559 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 58.6 p -72.18 -26.45 62.07 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 124.7 1.2 . . . . 0.0 113.523 177.207 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 39.7 m -80.85 88.94 5.82 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-N 119.336 0.971 . . . . 0.0 110.829 175.01 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 83.4 mt-30 -56.1 -30.97 62.82 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.205 1.402 . . . . 0.0 113.984 -176.694 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 69.4 m-20 -76.87 -21.73 54.51 Favored 'General case' 0 CA--C 1.545 0.784 0 N-CA-C 113.859 1.059 . . . . 0.0 113.859 178.257 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 66.8 mtp 51.3 32.67 8.62 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 126.105 1.762 . . . . 0.0 113.27 -173.488 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -147.97 154.12 39.91 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 124.691 1.196 . . . . 0.0 113.035 -170.346 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 6.9 t80 -153.94 155.64 36.0 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 124.922 1.289 . . . . 0.0 110.502 173.164 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 3.2 tmmm? -106.58 115.4 30.14 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 125.171 1.388 . . . . 0.0 111.985 -173.695 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 35.5 t -54.37 111.38 2.84 Favored Pre-proline 0 CA--C 1.545 0.768 0 C-N-CA 127.596 2.358 . . . . 0.0 111.279 174.876 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -62.74 -21.52 73.08 Favored 'Trans proline' 0 CA--C 1.539 0.755 0 C-N-CA 123.018 2.478 . . . . 0.0 114.957 178.894 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 96.7 mt -74.54 -57.56 6.34 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 C-N-CA 123.965 0.906 . . . . 0.0 111.164 -176.653 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 16.7 p -102.48 -0.94 31.54 Favored 'General case' 0 CA--C 1.551 0.986 0 N-CA-C 113.784 1.031 . . . . 0.0 113.784 -176.76 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 568' ' ' LYS . . . . . . . . . . . . . 32.9 mmtp 61.27 46.4 7.9 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 127.201 2.2 . . . . 0.0 112.985 -176.795 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 75.7 mt-10 -122.3 136.02 54.83 Favored 'General case' 0 N--CA 1.487 1.405 0 N-CA-C 114.737 1.384 . . . . 0.0 114.737 -173.916 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 79.2 m -83.49 116.85 22.73 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 112.896 0.702 . . . . 0.0 112.896 -179.016 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -85.27 147.56 5.43 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 C-N-CA 124.74 1.216 . . . . 0.0 110.116 167.068 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 58.4 p -133.32 151.37 51.87 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 125.636 1.574 . . . . 0.0 111.25 -179.37 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -70.15 158.53 53.5 Favored Glycine 0 CA--C 1.535 1.327 0 N-CA-C 114.965 0.746 . . . . 0.0 114.965 -176.034 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 9.2 p -140.52 143.37 29.26 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 125.099 1.36 . . . . 0.0 111.763 170.128 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 9.2 t80 -75.07 127.13 32.51 Favored 'General case' 0 CA--C 1.549 0.932 0 N-CA-C 113.905 1.076 . . . . 0.0 113.905 -173.922 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 37.7 t0 -97.85 101.19 12.63 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 125.812 1.645 . . . . 0.0 109.494 168.638 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -63.89 -26.61 68.68 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 124.651 1.181 . . . . 0.0 113.454 -179.194 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 73.2 mm-40 -78.03 -46.06 21.97 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 123.664 0.786 . . . . 0.0 112.468 -178.152 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 71.2 m -77.62 -29.36 51.76 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 123.446 0.698 . . . . 0.0 112.33 173.212 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 81.46 26.82 50.12 Favored Glycine 0 CA--C 1.534 1.257 0 C-N-CA 123.957 0.789 . . . . 0.0 112.963 -175.375 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 79.6 mm-40 -137.68 161.18 37.17 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 126.345 1.858 . . . . 0.0 110.148 -173.034 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 32.6 m95 -96.35 150.26 20.77 Favored 'General case' 0 CA--C 1.54 0.59 0 O-C-N 120.941 -1.1 . . . . 0.0 111.569 175.795 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 9.9 m -135.6 144.9 32.54 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 C-N-CA 125.299 1.44 . . . . 0.0 113.115 -173.686 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 3.2 m0 -92.0 104.86 17.22 Favored 'General case' 0 C--O 1.234 0.276 0 C-N-CA 126.67 1.988 . . . . 0.0 109.411 170.035 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -73.76 152.53 40.32 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 124.679 1.192 . . . . 0.0 112.104 178.421 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 54.73 29.86 12.49 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 125.519 1.527 . . . . 0.0 112.433 -177.662 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 62.0 m -125.05 149.22 48.01 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 124.517 1.127 . . . . 0.0 112.797 -169.303 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 14.9 tt -136.14 145.48 30.83 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.585 0 C-N-CA 127.906 2.482 . . . . 0.0 110.373 177.516 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 71.3 tt0 -107.77 123.48 48.61 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.659 1.184 . . . . 0.0 109.618 169.723 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 7.6 p -157.56 146.27 10.12 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 C-N-CA 124.774 1.23 . . . . 0.0 110.518 -177.028 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 8.2 t-20 52.88 35.19 18.36 Favored 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 124.642 1.177 . . . . 0.0 112.894 -175.649 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 68.67 14.39 67.29 Favored Glycine 0 CA--C 1.536 1.35 0 C-N-CA 125.5 1.524 . . . . 0.0 115.661 -178.291 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 35.9 mtmm -133.31 156.89 46.77 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 125.937 1.695 . . . . 0.0 111.456 -175.671 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 85.8 m-85 -90.74 147.26 23.36 Favored 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 113.001 0.741 . . . . 0.0 113.001 172.588 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 78.4 m-85 -150.44 160.72 43.56 Favored 'General case' 0 C--N 1.329 -0.326 0 C-N-CA 126.235 1.814 . . . . 0.0 110.043 -175.612 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 596' ' ' HIS . . . . . . . . . . . . . 26.0 m80 -75.2 139.08 42.4 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 108.486 -0.931 . . . . 0.0 108.486 167.136 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 59.2 p -59.91 -40.16 87.86 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.634 0.774 . . . . 0.0 111.812 177.653 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 9.4 p -71.25 -36.83 71.92 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 125.693 1.597 . . . . 0.0 113.113 176.72 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 599' ' ' CYS . . . . . . . . . . . . . 69.2 m -64.75 -59.48 4.18 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.353 1.061 . . . . 0.0 111.186 174.795 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 61.7 t80 -53.3 -41.51 65.7 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.363 1.065 . . . . 0.0 113.069 -177.179 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 83.2 t60 -61.4 -34.2 74.95 Favored 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 114.879 1.437 . . . . 0.0 114.879 -177.476 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 35.1 tp10 -102.22 -18.75 15.36 Favored 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 114.196 1.184 . . . . 0.0 114.196 -176.277 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 50.1 m -77.34 -32.01 54.85 Favored 'General case' 0 N--CA 1.481 1.09 0 N-CA-C 115.993 1.849 . . . . 0.0 115.993 -167.977 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 604' ' ' SER . . . . . . . . . . . . . 26.6 t -64.48 123.17 18.53 Favored 'General case' 0 N--CA 1.477 0.918 0 CA-C-N 119.789 1.177 . . . . 0.0 113.186 -173.103 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 605' ' ' GLN . . . . . . . . . . . . . 66.2 mt-30 -97.96 -27.37 14.28 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 124.58 1.152 . . . . 0.0 113.671 -178.251 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 606' ' ' ASN . . . . . . . . . . . . . 14.9 t-20 -83.88 171.18 13.31 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 124.789 1.236 . . . . 0.0 112.459 -174.242 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 607' ' ' SER . . . . . . . . . . . . . 19.3 m 59.25 34.19 22.95 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 125.693 1.597 . . . . 0.0 114.063 176.413 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 608' ' ' SER . . . . . . . . . . . . . 22.8 t . . . . . 0 C--O 1.254 1.317 0 C-N-CA 125.453 1.501 . . . . 0.0 112.551 176.624 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 533' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.626 0 N-CA-C 112.241 -0.344 . . . . 0.0 112.241 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 80.57 4.42 90.15 Favored Glycine 0 CA--C 1.539 1.578 0 C-N-CA 124.788 1.185 . . . . 0.0 115.649 179.14 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 535' ' ' SER . . . . . . . . . . . . . 26.7 m -76.1 58.4 1.21 Allowed 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 126.279 1.831 . . . . 0.0 112.339 179.05 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 536' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -143.36 153.75 43.03 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 125.198 1.399 . . . . 0.0 112.562 -173.125 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 537' ' ' PHE . . . . . . . . . . . . . 86.1 m-85 -75.99 153.2 36.7 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.389 1.076 . . . . 0.0 112.944 178.921 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 14.1 t -158.59 -174.92 5.02 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 126.027 1.731 . . . . 0.0 110.751 -178.599 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 539' ' ' ASP . . . . . . . . . . . . . 68.8 m-20 -70.53 3.11 3.28 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 125.583 1.553 . . . . 0.0 114.194 174.771 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 540' ' ' ARG . . . . . . . . . . . . . 3.1 ttp180 -70.79 66.05 0.35 Allowed 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 127.435 2.294 . . . . 0.0 113.056 179.258 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 17.0 t -74.23 -145.72 0.02 OUTLIER 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 125.97 1.708 . . . . 0.0 110.865 170.618 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 542' ' ' ASN . . . . . . . . . . . . . 40.2 p-10 -65.28 11.53 0.06 Allowed 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 126.082 1.753 . . . . 0.0 115.409 174.031 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 8.9 mm-40 -51.22 -41.33 60.22 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 126.37 1.868 . . . . 0.0 112.75 179.448 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 11.0 mp -62.15 -33.81 75.2 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 124.152 0.981 . . . . 0.0 111.86 179.032 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 32.6 tp10 -82.6 -36.67 25.95 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 123.541 0.736 . . . . 0.0 112.689 179.929 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 30.0 mm -64.86 -41.61 92.62 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 C-N-CA 123.349 0.66 . . . . 0.0 110.891 172.256 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 71.4 mtp180 -85.68 -20.8 28.84 Favored 'General case' 0 N--CA 1.481 1.1 0 N-CA-C 113.389 0.885 . . . . 0.0 113.389 -175.279 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -72.63 -10.97 76.92 Favored Glycine 0 CA--C 1.54 1.626 0 C-N-CA 125.467 1.508 . . . . 0.0 114.466 171.686 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 70.1 mmtt -66.34 140.12 58.07 Favored 'General case' 0 N--CA 1.477 0.918 0 CA-C-N 119.089 1.444 . . . . 0.0 111.747 173.271 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 46.1 p90 -153.79 164.86 37.64 Favored 'General case' 0 C--O 1.238 0.467 0 C-N-CA 124.253 1.021 . . . . 0.0 111.723 169.613 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -134.37 135.33 54.21 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 C-N-CA 125.563 1.545 . . . . 0.0 109.736 175.045 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 53.9 t -67.95 133.07 32.21 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.104 0 C-N-CA 123.741 0.816 . . . . 0.0 110.731 -177.349 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 553' ' ' VAL . . . . . 0.451 HG22 ' CD2' ' A' ' 584' ' ' TRP . 5.3 t -84.92 116.17 64.21 Favored Pre-proline 0 CA--C 1.541 0.61 0 C-N-CA 124.117 0.967 . . . . 0.0 109.84 173.805 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -76.69 163.33 31.76 Favored 'Trans proline' 0 CA--C 1.536 0.623 0 C-N-CA 122.509 2.139 . . . . 0.0 112.162 176.887 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 39.8 mm-40 -62.38 -28.64 69.91 Favored 'General case' 0 CA--C 1.548 0.895 0 O-C-N 121.296 -0.878 . . . . 0.0 112.562 173.04 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 69.7 p -67.59 -18.0 64.84 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 125.038 1.335 . . . . 0.0 113.322 175.793 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 18.2 m -80.81 -0.6 39.46 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 114.335 1.235 . . . . 0.0 114.335 169.684 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 88.4 mt-30 45.36 -84.43 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 128.571 2.748 . . . . 0.0 116.621 169.268 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 71.1 m-20 -70.83 -9.35 57.35 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 125.446 1.498 . . . . 0.0 113.914 178.738 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 12.1 mtt 57.99 31.14 20.23 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 126.002 1.721 . . . . 0.0 115.043 178.024 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -122.56 141.84 51.25 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 124.024 0.93 . . . . 0.0 112.943 -177.401 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -149.59 157.84 43.62 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 124.979 1.312 . . . . 0.0 111.436 179.703 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 39.2 ttpt -104.11 144.95 30.88 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 124.795 1.238 . . . . 0.0 114.197 -170.553 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 12.2 t -100.63 107.21 47.64 Favored Pre-proline 0 CA--C 1.541 0.632 0 C-N-CA 126.833 2.053 . . . . 0.0 108.607 166.943 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo -69.96 -16.96 36.91 Favored 'Trans proline' 0 CA--C 1.546 1.097 0 C-N-CA 122.502 2.134 . . . . 0.0 113.443 177.53 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 87.6 mt -72.9 -57.78 6.3 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 C-N-CA 124.12 0.968 . . . . 0.0 111.13 -178.957 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 15.5 p -98.11 -1.93 41.22 Favored 'General case' 0 CA--C 1.552 1.022 0 N-CA-C 113.648 0.981 . . . . 0.0 113.648 179.697 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 568' ' ' LYS . . . . . . . . . . . . . 45.6 tttt 59.73 45.84 12.37 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 126.522 1.929 . . . . 0.0 112.705 -177.736 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 70.3 mm-40 -117.59 166.09 12.79 Favored 'General case' 0 N--CA 1.482 1.149 0 N-CA-C 112.83 0.678 . . . . 0.0 112.83 -178.688 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 89.7 m -112.2 118.53 35.57 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.972 0.909 . . . . 0.0 111.199 179.34 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 3.5 m -79.53 138.58 19.71 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 123.486 0.715 . . . . 0.0 110.26 167.721 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 41.4 p -120.99 142.56 49.67 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 124.818 1.247 . . . . 0.0 110.077 176.307 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -65.92 144.15 46.15 Favored Glycine 0 CA--C 1.533 1.18 0 O-C-N 122.067 -0.395 . . . . 0.0 112.804 178.788 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 86.4 t -129.24 131.95 67.25 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 C-N-CA 125.237 1.415 . . . . 0.0 110.938 -178.901 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 71.5 t80 -71.82 117.49 13.48 Favored 'General case' 0 CA--C 1.549 0.912 0 CA-C-N 118.622 0.647 . . . . 0.0 112.315 -178.395 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 39.7 t0 -84.45 111.01 19.09 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.534 1.134 . . . . 0.0 109.469 169.016 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 54.5 mt-10 -68.9 -24.16 64.28 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 113.672 0.99 . . . . 0.0 113.672 -179.22 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 61.0 mt-10 -77.32 -42.0 38.43 Favored 'General case' 0 N--CA 1.475 0.788 0 O-C-N 121.207 -0.933 . . . . 0.0 112.908 -176.166 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 96.8 p -91.34 -24.74 19.7 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.852 0.861 . . . . 0.0 113.092 172.366 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 82.05 32.16 29.94 Favored Glycine 0 CA--C 1.533 1.159 0 C-N-CA 124.228 0.918 . . . . 0.0 113.124 -178.61 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 61.4 mm-40 -134.49 149.55 50.71 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 125.189 1.396 . . . . 0.0 111.439 -173.881 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 78.4 m95 -79.62 141.7 36.28 Favored 'General case' 0 CA--C 1.535 0.402 0 O-C-N 121.22 -0.925 . . . . 0.0 111.257 171.668 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 21.1 m -137.01 143.85 33.74 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 C-N-CA 125.703 1.601 . . . . 0.0 113.124 -174.973 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 584' ' ' TRP . . . . . 0.451 ' CD2' HG22 ' A' ' 553' ' ' VAL . 2.2 m0 -95.64 102.27 14.05 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 126.561 1.944 . . . . 0.0 107.739 170.37 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -79.32 148.75 31.98 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.873 1.269 . . . . 0.0 112.224 -176.873 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 61.0 t30 52.41 36.27 19.56 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.759 1.624 . . . . 0.0 112.805 -173.174 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 86.4 m -119.55 147.67 44.19 Favored 'General case' 0 N--CA 1.479 0.982 0 O-C-N 120.739 -1.226 . . . . 0.0 112.064 -172.589 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 8.9 tt -145.16 145.49 20.71 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.586 0 C-N-CA 127.312 2.245 . . . . 0.0 110.78 -177.123 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 63.0 tt0 -113.39 128.83 56.59 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.867 1.267 . . . . 0.0 109.417 168.009 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 7.5 p -152.52 135.9 7.8 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.832 0 C-N-CA 125.35 1.46 . . . . 0.0 110.636 -178.058 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 72.4 m-20 53.99 34.01 18.75 Favored 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 124.868 1.267 . . . . 0.0 113.756 -176.129 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 78.02 11.87 84.95 Favored Glycine 0 CA--C 1.537 1.465 0 C-N-CA 124.985 1.279 . . . . 0.0 115.484 -179.899 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -129.86 150.76 51.01 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 125.311 1.444 . . . . 0.0 111.559 -178.528 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 14.2 m-85 -93.48 147.21 23.18 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.611 1.165 . . . . 0.0 112.238 177.749 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 95.3 m-85 -154.08 165.08 37.31 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 126.027 1.731 . . . . 0.0 111.176 -177.248 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 596' ' ' HIS . . . . . 0.431 ' HB2' ' HB2' ' A' ' 599' ' ' CYS . 21.5 m80 -79.32 142.45 36.08 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 108.142 -1.058 . . . . 0.0 108.142 165.424 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 7.8 t -66.56 -39.06 88.33 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 118.997 0.817 . . . . 0.0 112.012 -178.144 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 21.7 p -63.4 -44.53 94.38 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.109 0.963 . . . . 0.0 112.974 171.781 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 599' ' ' CYS . . . . . 0.431 ' HB2' ' HB2' ' A' ' 596' ' ' HIS . 93.1 m -62.32 -50.96 69.56 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.042 0.937 . . . . 0.0 111.044 177.367 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 56.9 t80 -57.37 -43.75 83.84 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 123.778 0.831 . . . . 0.0 111.889 176.517 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 84.4 t60 -62.55 -40.76 97.86 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 123.64 0.776 . . . . 0.0 112.718 178.454 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 73.3 mm-40 -69.28 -36.86 77.52 Favored 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 113.46 0.911 . . . . 0.0 113.46 173.496 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 71.4 m -77.22 -45.18 27.39 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 124.077 0.951 . . . . 0.0 112.369 -176.883 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 604' ' ' SER . . . . . . . . . . . . . 8.3 t -81.02 55.92 2.63 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.603 1.561 . . . . 0.0 111.513 177.737 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 605' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.2 150.23 49.1 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 124.443 1.097 . . . . 0.0 113.094 -175.416 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 606' ' ' ASN . . . . . . . . . . . . . 58.7 t30 54.32 -91.92 0.03 OUTLIER 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 126.78 2.032 . . . . 0.0 113.79 -176.414 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 607' ' ' SER . . . . . . . . . . . . . 27.3 t -156.76 141.43 16.87 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 125.679 1.592 . . . . 0.0 111.136 177.834 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 608' ' ' SER . . . . . . . . . . . . . 49.7 p . . . . . 0 C--O 1.255 1.347 0 C-N-CA 125.813 1.645 . . . . 0.0 114.059 -178.477 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 533' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.621 0 N-CA-C 111.637 -0.585 . . . . 0.0 111.637 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . -72.17 137.02 24.54 Favored Glycine 0 CA--C 1.536 1.403 0 C-N-CA 124.083 0.849 . . . . 0.0 113.443 179.909 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 535' ' ' SER . . . . . . . . . . . . . 35.5 m -72.59 146.05 46.95 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 124.955 1.302 . . . . 0.0 112.994 179.611 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 536' ' ' GLU . . . . . . . . . . . . . 46.7 tt0 -82.49 84.34 7.24 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.253 1.021 . . . . 0.0 110.997 172.48 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 537' ' ' PHE . . . . . . . . . . . . . 63.9 t80 -74.55 161.32 29.85 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 124.896 1.278 . . . . 0.0 112.721 178.846 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 77.6 p -142.3 140.67 32.25 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 125.326 1.45 . . . . 0.0 112.222 177.877 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 539' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 -73.34 148.54 43.37 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.777 1.231 . . . . 0.0 113.891 -175.246 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 540' ' ' ARG . . . . . . . . . . . . . 31.1 mmm180 -89.72 -39.6 13.06 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 124.779 1.232 . . . . 0.0 112.992 175.281 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 43.4 t -165.0 153.02 11.64 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 125.358 1.463 . . . . 0.0 112.418 -173.304 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 542' ' ' ASN . . . . . . . . . . . . . 8.5 p-10 -65.3 -14.24 60.31 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 124.113 0.965 . . . . 0.0 113.003 169.209 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 -68.11 -19.67 64.86 Favored 'General case' 0 CA--C 1.543 0.685 0 O-C-N 120.717 -1.24 . . . . 0.0 113.358 172.748 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 81.9 mt -72.43 -38.04 68.45 Favored 'General case' 0 N--CA 1.471 0.598 0 O-C-N 121.356 -0.84 . . . . 0.0 111.654 170.05 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 47.6 tp10 -68.52 -15.18 63.45 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 125.401 1.48 . . . . 0.0 113.31 -177.966 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 23.3 mm -56.56 -41.6 73.73 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 C-N-CA 125.165 1.386 . . . . 0.0 111.173 173.568 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 21.2 mmt85 -65.54 -36.65 84.42 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 124.526 1.131 . . . . 0.0 112.321 176.682 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -68.4 -14.27 66.47 Favored Glycine 0 CA--C 1.528 0.901 0 C-N-CA 126.215 1.864 . . . . 0.0 114.278 -179.886 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 65.7 mmtt -76.6 95.26 3.9 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 118.731 1.265 . . . . 0.0 108.659 168.799 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 30.9 p90 -105.91 162.0 13.96 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 113.736 -1.575 . . . . 0.0 111.814 170.353 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 4.3 m -127.85 142.25 44.21 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.617 0 C-N-CA 125.912 1.685 . . . . 0.0 109.803 172.042 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 94.5 t -69.19 135.32 28.59 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 O-C-N 121.606 -0.684 . . . . 0.0 110.742 -176.656 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 97.5 t -68.98 119.73 71.67 Favored Pre-proline 0 CA--C 1.545 0.752 0 C-N-CA 124.04 0.936 . . . . 0.0 108.985 173.283 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo -76.21 154.67 37.07 Favored 'Trans proline' 0 CA--C 1.535 0.568 0 C-N-CA 123.189 2.593 . . . . 0.0 112.472 -177.556 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 17.3 pt-20 -65.3 -17.29 64.39 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 113.199 0.814 . . . . 0.0 113.199 173.779 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 77.4 p -73.09 -22.39 60.58 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.113 0.965 . . . . 0.0 113.005 173.807 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 30.5 t -79.2 110.38 14.41 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 119.281 0.946 . . . . 0.0 110.889 173.578 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 26.5 mp0 -71.95 -31.11 66.0 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.208 1.003 . . . . 0.0 112.53 -178.635 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 66.6 m-20 -108.71 -2.8 18.36 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 125.508 1.523 . . . . 0.0 113.998 -174.793 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 7.4 mtt 55.22 37.53 29.04 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.524 1.53 . . . . 0.0 112.889 -171.718 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -133.02 142.19 48.68 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.312 1.045 . . . . 0.0 113.292 -173.338 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 28.0 t80 -152.63 159.76 43.2 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 125.799 1.64 . . . . 0.0 109.789 174.09 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 38.8 ttmt -118.16 134.71 54.75 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 124.583 1.153 . . . . 0.0 113.737 -170.429 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 19.6 t -73.03 116.78 53.96 Favored Pre-proline 0 CA--C 1.541 0.617 0 C-N-CA 126.104 1.762 . . . . 0.0 110.509 169.308 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 93.2 Cg_endo -71.77 -18.04 28.8 Favored 'Trans proline' 0 CA--C 1.543 0.951 0 C-N-CA 122.892 2.394 . . . . 0.0 113.974 173.315 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 73.6 mt -72.04 -56.67 9.37 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 C-N-CA 123.948 0.899 . . . . 0.0 110.413 -177.456 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 15.6 p -100.99 -0.67 36.11 Favored 'General case' 0 CA--C 1.552 1.055 0 N-CA-C 113.911 1.078 . . . . 0.0 113.911 178.994 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 568' ' ' LYS . . . . . . . . . . . . . 33.6 tttt 63.73 39.61 8.42 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 126.644 1.978 . . . . 0.0 113.824 -179.041 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 78.6 mm-40 -123.59 138.49 54.54 Favored 'General case' 0 N--CA 1.481 1.099 0 N-CA-C 114.136 1.161 . . . . 0.0 114.136 -171.976 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 80.5 m -83.64 122.48 28.66 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 124.589 1.155 . . . . 0.0 112.42 -179.28 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 1.7 t -79.33 141.49 15.29 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 C-N-CA 124.715 1.206 . . . . 0.0 109.223 168.106 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 43.1 p -113.66 138.72 49.81 Favored 'General case' 0 N--CA 1.475 0.825 0 C-N-CA 124.67 1.188 . . . . 0.0 109.997 169.28 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -65.97 150.8 51.94 Favored Glycine 0 CA--C 1.535 1.287 0 C-N-CA 124.756 1.169 . . . . 0.0 113.756 -178.44 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 84.3 t -138.05 133.7 44.31 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.858 0 C-N-CA 125.747 1.619 . . . . 0.0 111.598 -176.291 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 70.2 t80 -69.27 141.75 54.29 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-N 119.742 1.156 . . . . 0.0 113.039 179.067 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -126.6 130.64 50.9 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.543 1.137 . . . . 0.0 111.445 172.788 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 80.9 mt-10 -71.72 -25.79 62.22 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 113.541 0.941 . . . . 0.0 113.541 176.848 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -74.23 -42.13 60.23 Favored 'General case' 0 N--CA 1.479 1.023 0 CA-C-N 118.98 0.809 . . . . 0.0 111.481 177.859 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 33.1 m -75.11 -31.57 61.17 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 124.302 1.041 . . . . 0.0 112.029 171.037 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 71.39 22.25 78.59 Favored Glycine 0 CA--C 1.534 1.226 0 C-N-CA 123.959 0.79 . . . . 0.0 112.265 -169.74 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -153.82 166.95 31.29 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 126.382 1.873 . . . . 0.0 112.13 -169.406 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 70.2 m95 -76.69 142.99 40.34 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.728 1.211 . . . . 0.0 111.893 175.718 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 28.9 m -139.74 148.09 23.4 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 C-N-CA 126.663 1.985 . . . . 0.0 112.086 -172.906 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 4.7 m0 -97.71 98.98 10.33 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 127.386 2.275 . . . . 0.0 107.598 170.851 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 66.3 mttm -75.22 154.4 37.57 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 124.412 1.085 . . . . 0.0 111.525 179.808 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 62.1 t30 49.59 40.23 19.0 Favored 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 125.087 1.355 . . . . 0.0 112.411 -174.509 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 96.8 m -130.12 137.94 50.41 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 124.835 1.254 . . . . 0.0 111.383 -175.921 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 11.1 tt -133.75 140.13 47.2 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 C-N-CA 126.363 1.865 . . . . 0.0 112.121 -168.989 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 69.2 tt0 -97.51 132.34 43.29 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.502 1.121 . . . . 0.0 110.621 169.863 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 7.7 p -145.79 127.57 8.35 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.616 0 C-N-CA 125.352 1.461 . . . . 0.0 111.02 171.985 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 61.9 m-20 53.3 36.81 23.75 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 124.993 1.317 . . . . 0.0 113.828 175.372 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 79.67 8.5 87.67 Favored Glycine 0 CA--C 1.539 1.575 0 C-N-CA 124.67 1.129 . . . . 0.0 115.383 -179.368 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 58.9 mtmt -123.5 160.69 26.41 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 126.29 1.836 . . . . 0.0 111.114 178.247 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 75.3 m-85 -113.27 143.19 44.84 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 124.177 0.991 . . . . 0.0 113.635 179.832 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 21.5 m-30 -139.93 171.82 13.66 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 128.247 2.619 . . . . 0.0 109.77 179.709 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 596' ' ' HIS . . . . . 0.435 ' HB2' ' HB2' ' A' ' 599' ' ' CYS . 20.0 m80 -83.79 143.05 30.22 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 107.976 -1.12 . . . . 0.0 107.976 166.409 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 11.3 m -65.26 -41.35 94.35 Favored 'General case' 0 N--CA 1.473 0.68 0 O-C-N 122.089 -0.382 . . . . 0.0 111.897 -176.72 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 21.3 p -65.55 -42.01 92.36 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-O 118.561 -0.733 . . . . 0.0 112.843 171.84 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 599' ' ' CYS . . . . . 0.435 ' HB2' ' HB2' ' A' ' 596' ' ' HIS . 67.4 m -59.83 -54.02 51.17 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 119.301 0.955 . . . . 0.0 111.605 178.883 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -54.73 -51.83 64.4 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 123.246 0.618 . . . . 0.0 109.929 175.093 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 85.8 t60 -56.71 -45.86 81.61 Favored 'General case' 0 N--CA 1.47 0.542 0 N-CA-C 114.222 1.193 . . . . 0.0 114.222 -179.607 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -80.49 -26.91 37.92 Favored 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 113.946 1.091 . . . . 0.0 113.946 -179.176 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 93.0 m -84.3 -33.73 23.89 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.936 0.895 . . . . 0.0 112.109 -177.854 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 604' ' ' SER . . . . . . . . . . . . . 11.1 t -144.8 71.17 1.29 Allowed 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 124.819 1.248 . . . . 0.0 110.811 -176.522 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 605' ' ' GLN . . . . . . . . . . . . . 52.7 tt0 -70.91 -31.22 67.78 Favored 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 123.88 0.872 . . . . 0.0 112.354 177.118 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 606' ' ' ASN . . . . . . . . . . . . . 62.2 t30 -70.65 154.01 42.28 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 125.258 1.423 . . . . 0.0 112.071 173.799 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 607' ' ' SER . . . . . . . . . . . . . 49.2 m -126.39 148.17 49.65 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 124.978 1.311 . . . . 0.0 112.853 -177.09 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 608' ' ' SER . . . . . . . . . . . . . 6.7 t . . . . . 0 C--O 1.254 1.328 0 C-N-CA 127.824 2.45 . . . . 0.0 114.068 -177.616 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 533' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.629 0 N-CA-C 112.078 -0.409 . . . . 0.0 112.078 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . -72.25 164.48 54.45 Favored Glycine 0 CA--C 1.538 1.516 0 C-N-CA 124.332 0.967 . . . . 0.0 114.158 177.317 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 535' ' ' SER . . . . . . . . . . . . . 80.8 p -153.49 153.77 33.08 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 125.225 1.41 . . . . 0.0 112.316 -179.128 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 536' ' ' GLU . . . . . . . . . . . . . 24.5 mp0 -77.85 151.71 33.76 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.392 1.077 . . . . 0.0 112.084 175.288 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 537' ' ' PHE . . . . . . . . . . . . . 3.3 t80 -82.86 10.43 7.79 Favored 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 125.18 1.392 . . . . 0.0 113.59 -179.917 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 18.9 m -62.46 130.78 46.74 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 125.386 1.474 . . . . 0.0 113.071 -173.368 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 539' ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -74.38 149.45 40.52 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.202 1.401 . . . . 0.0 113.95 -173.526 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 540' ' ' ARG . . . . . . . . . . . . . 10.6 mpt_? -116.11 167.97 10.52 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 126.644 1.978 . . . . 0.0 111.731 177.362 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 23.4 t -61.1 -31.49 71.18 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 124.839 1.255 . . . . 0.0 114.14 -177.297 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 542' ' ' ASN . . . . . . . . . . . . . 5.4 p-10 -144.42 151.6 39.46 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.847 1.659 . . . . 0.0 110.941 174.427 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 31.2 tp10 -91.56 -65.42 1.01 Allowed 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 123.791 0.836 . . . . 0.0 112.874 -174.867 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -155.65 -8.5 0.12 Allowed 'General case' 0 N--CA 1.48 1.073 0 N-CA-C 116.861 2.171 . . . . 0.0 116.861 -174.618 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -60.23 -22.02 62.52 Favored 'General case' 0 N--CA 1.478 0.936 0 N-CA-C 116.001 1.852 . . . . 0.0 116.001 -168.061 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 22.3 mm -52.66 -42.06 39.77 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 C-N-CA 124.968 1.307 . . . . 0.0 113.032 -173.111 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 23.4 ptt180 -72.11 -17.79 61.95 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 113.661 0.986 . . . . 0.0 113.661 -176.625 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -75.62 -11.39 84.47 Favored Glycine 0 CA--C 1.535 1.33 0 C-N-CA 124.856 1.217 . . . . 0.0 114.165 -178.071 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -70.56 131.69 44.37 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 118.565 1.182 . . . . 0.0 110.732 174.766 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 50.0 p90 -140.58 163.94 31.51 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 124.79 1.236 . . . . 0.0 111.967 174.624 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 21.3 m -127.92 143.29 41.28 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 C-N-CA 126.004 1.721 . . . . 0.0 109.733 172.689 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 92.3 t -69.67 134.61 29.84 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.149 0 O-C-N 120.662 -1.274 . . . . 0.0 109.747 175.644 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 85.7 t -63.27 122.96 78.83 Favored Pre-proline 0 CA--C 1.544 0.746 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 179.137 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -72.85 151.07 50.61 Favored 'Trans proline' 0 CA--C 1.538 0.681 0 C-N-CA 122.572 2.182 . . . . 0.0 112.684 -175.595 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 16.0 pt-20 -62.61 -21.01 65.32 Favored 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 113.87 1.063 . . . . 0.0 113.87 179.359 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 45.8 p -74.68 -30.18 61.48 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 125.629 1.572 . . . . 0.0 113.208 176.014 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 62.3 m -87.19 79.76 8.49 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 123.617 0.767 . . . . 0.0 112.006 -177.911 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 85.9 mt-30 -58.4 -32.97 69.13 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 125.138 1.375 . . . . 0.0 113.501 -177.702 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 16.6 t0 -77.65 -12.47 59.97 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 124.764 1.226 . . . . 0.0 113.297 176.604 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 6.5 mtt 52.75 35.99 20.02 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 126.135 1.774 . . . . 0.0 113.364 -175.978 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -142.05 149.73 40.33 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.364 1.065 . . . . 0.0 112.47 -178.221 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 9.3 t80 -153.32 155.24 36.12 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 124.01 0.924 . . . . 0.0 110.825 177.329 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 28.3 ttpp -99.85 134.31 42.95 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 123.969 0.908 . . . . 0.0 113.27 -175.47 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 40.7 t -76.27 116.13 53.34 Favored Pre-proline 0 CA--C 1.541 0.614 0 C-N-CA 127.006 2.122 . . . . 0.0 110.622 169.286 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -62.66 -28.31 76.67 Favored 'Trans proline' 0 CA--C 1.542 0.901 0 C-N-CA 122.708 2.272 . . . . 0.0 114.597 175.686 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 87.3 mt -70.6 -60.47 2.41 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.2 0 CA-C-N 118.845 0.748 . . . . 0.0 111.427 -174.54 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 15.6 p -93.72 -1.99 54.39 Favored 'General case' 0 CA--C 1.549 0.929 0 N-CA-C 113.596 0.961 . . . . 0.0 113.596 179.837 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 568' ' ' LYS . . . . . . . . . . . . . 2.2 mptp? 60.48 43.47 13.06 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 126.959 2.104 . . . . 0.0 112.205 -177.417 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 75.0 mm-40 -123.31 140.73 52.71 Favored 'General case' 0 N--CA 1.482 1.134 0 N-CA-C 114.401 1.26 . . . . 0.0 114.401 -173.645 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 97.5 m -82.06 116.74 21.79 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 123.863 0.865 . . . . 0.0 111.817 179.078 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 2.9 p -79.56 149.47 5.36 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.885 0 C-N-CA 124.411 1.084 . . . . 0.0 110.076 167.949 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 44.5 p -126.07 142.8 51.37 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 124.816 1.246 . . . . 0.0 111.319 -179.376 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -72.81 147.11 39.48 Favored Glycine 0 CA--C 1.529 0.932 0 C-N-CA 124.758 1.171 . . . . 0.0 112.893 -178.291 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 62.5 t -135.09 130.23 51.47 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.421 0 C-N-CA 124.583 1.153 . . . . 0.0 111.749 -178.979 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 68.5 t80 -68.39 115.78 8.21 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 122.993 0.517 . . . . 0.0 112.078 178.354 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 37.2 t0 -86.44 119.4 26.66 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 123.89 0.876 . . . . 0.0 110.006 169.386 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 63.7 mt-10 -69.25 -23.1 63.81 Favored 'General case' 0 CA--C 1.548 0.869 0 N-CA-C 113.2 0.815 . . . . 0.0 113.2 177.18 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 8.4 tm-20 -79.78 -47.76 14.69 Favored 'General case' 0 CA--C 1.541 0.61 0 O-C-N 121.211 -0.931 . . . . 0.0 111.724 -179.38 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 47.7 m -71.94 -28.42 63.45 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.775 0.83 . . . . 0.0 112.379 169.953 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 75.21 24.27 71.71 Favored Glycine 0 CA--C 1.533 1.212 0 C-N-CA 124.686 1.136 . . . . 0.0 113.933 -173.538 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -148.13 159.86 43.49 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 125.983 1.713 . . . . 0.0 111.812 -170.791 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 73.7 m95 -76.87 139.69 40.34 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 123.922 0.889 . . . . 0.0 111.731 -179.894 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 16.8 m -132.87 150.43 32.95 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 126.039 1.736 . . . . 0.0 112.591 -179.181 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 7.8 m0 -100.15 101.43 12.47 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 127.409 2.283 . . . . 0.0 107.829 173.079 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 73.8 mmtt -70.71 151.75 44.57 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 124.986 1.314 . . . . 0.0 111.56 -178.688 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 59.4 t30 49.57 40.4 19.3 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 125.442 1.497 . . . . 0.0 112.962 -177.862 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 99.9 m -123.86 147.74 47.37 Favored 'General case' 0 N--CA 1.485 1.309 0 O-C-N 121.005 -1.06 . . . . 0.0 112.476 -171.232 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 16.4 tt -142.55 148.73 19.67 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.631 0 C-N-CA 127.75 2.42 . . . . 0.0 110.049 -178.169 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 69.5 tt0 -108.34 130.47 55.2 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.421 1.088 . . . . 0.0 110.784 170.294 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 9.4 p -153.31 145.47 14.79 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.911 0 C-N-CA 125.06 1.344 . . . . 0.0 110.503 177.069 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 8.1 t-20 53.59 30.94 11.62 Favored 'General case' 0 CA--C 1.552 1.028 0 C-N-CA 124.944 1.297 . . . . 0.0 113.571 -177.655 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 76.6 11.22 85.43 Favored Glycine 0 CA--C 1.539 1.585 0 C-N-CA 124.976 1.274 . . . . 0.0 115.916 -179.323 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -135.25 161.03 36.55 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 125.914 1.686 . . . . 0.0 112.365 -179.75 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 69.6 m-85 -90.05 150.24 22.18 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 113.684 0.994 . . . . 0.0 113.684 178.258 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 89.1 m-85 -149.94 163.28 38.51 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 127.382 2.273 . . . . 0.0 109.955 -176.63 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 596' ' ' HIS . . . . . 0.403 ' HB2' ' HB2' ' A' ' 599' ' ' CYS . 29.4 m80 -81.07 140.61 35.0 Favored 'General case' 0 N--CA 1.471 0.602 0 O-C-N 121.343 -0.848 . . . . 0.0 109.224 168.716 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 23.6 t -62.62 -45.43 92.88 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 123.353 0.661 . . . . 0.0 112.02 -178.695 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 24.5 p -63.36 -44.34 95.1 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 123.871 0.868 . . . . 0.0 112.777 173.929 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 599' ' ' CYS . . . . . 0.403 ' HB2' ' HB2' ' A' ' 596' ' ' HIS . 97.2 m -57.77 -53.57 56.72 Favored 'General case' 0 CA--C 1.544 0.72 0 CA-C-N 119.134 0.879 . . . . 0.0 111.404 176.897 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 80.9 t80 -57.82 -45.79 85.63 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.335 1.054 . . . . 0.0 112.308 177.367 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 48.1 t-80 -62.9 -43.05 99.84 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 124.005 0.922 . . . . 0.0 113.011 177.628 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 62.9 mt-10 -73.0 -30.38 63.74 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 123.867 0.867 . . . . 0.0 113.117 178.342 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 51.5 m -73.21 -35.68 66.38 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 124.267 1.027 . . . . 0.0 112.13 175.01 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 604' ' ' SER . . . . . . . . . . . . . 33.3 t -63.91 134.04 54.4 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.273 1.029 . . . . 0.0 112.072 174.202 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 605' ' ' GLN . . . . . . . . . . . . . 76.1 mt-30 -143.25 161.02 39.39 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 125.691 1.596 . . . . 0.0 111.488 -175.911 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 606' ' ' ASN . . . . . . . . . . . . . 62.3 t30 55.99 33.37 21.66 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 125.561 1.544 . . . . 0.0 113.954 179.854 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 607' ' ' SER . . . . . . . . . . . . . 24.2 t -67.06 -27.25 67.23 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 124.72 1.208 . . . . 0.0 113.646 -175.796 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 608' ' ' SER . . . . . . . . . . . . . 39.8 m . . . . . 0 C--O 1.254 1.309 0 C-N-CA 127.14 2.176 . . . . 0.0 113.475 179.736 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 533' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.498 0 N-CA-C 111.206 -0.758 . . . . 0.0 111.206 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . -176.13 165.85 36.61 Favored Glycine 0 CA--C 1.537 1.408 0 C-N-CA 124.571 1.081 . . . . 0.0 113.38 178.246 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 535' ' ' SER . . . . . . . . . . . . . 82.6 p -76.42 164.22 26.2 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.976 1.31 . . . . 0.0 112.931 176.384 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 536' ' ' GLU . . . . . . . . . . . . . 60.9 mt-10 -74.25 93.51 2.36 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 124.086 0.955 . . . . 0.0 111.213 173.446 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 537' ' ' PHE . . . . . . . . . . . . . 23.8 t80 -147.3 134.78 20.84 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.454 1.502 . . . . 0.0 109.944 175.943 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 28.9 t -80.83 -81.51 0.13 Allowed 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 115.237 1.569 . . . . 0.0 115.237 -168.054 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 539' ' ' ASP . . . . . . . . . . . . . 12.7 p-10 -80.73 153.53 27.77 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 124.586 1.155 . . . . 0.0 112.953 -170.81 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 540' ' ' ARG . . . . . . . . . . . . . 6.5 mpt_? 51.12 42.31 28.55 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 124.943 1.297 . . . . 0.0 112.337 -176.385 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 47.3 t -146.81 163.93 34.44 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 126.839 2.055 . . . . 0.0 111.207 -174.927 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 542' ' ' ASN . . . . . . . . . . . . . 81.3 m-20 -60.0 -25.61 65.4 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.003 0.921 . . . . 0.0 113.367 178.526 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 29.6 tp10 -58.65 -35.07 71.94 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 124.199 0.999 . . . . 0.0 113.065 173.441 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 10.5 tt -76.11 -43.69 42.11 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 124.024 0.93 . . . . 0.0 110.942 172.659 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -70.36 -46.6 63.79 Favored 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 114.144 1.164 . . . . 0.0 114.144 -171.433 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 24.0 mm -60.67 -32.12 50.93 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.003 0 CA-C-N 118.925 0.784 . . . . 0.0 111.324 -174.993 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 88.8 mtt-85 -70.1 -30.38 67.59 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 124.105 0.962 . . . . 0.0 112.959 176.905 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -79.73 -9.47 86.77 Favored Glycine 0 CA--C 1.536 1.369 0 C-N-CA 125.637 1.589 . . . . 0.0 114.535 178.572 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 58.9 mtpt -75.64 132.62 40.73 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.719 1.207 . . . . 0.0 111.154 177.063 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 23.5 p90 -153.3 166.55 32.24 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 125.234 1.414 . . . . 0.0 111.387 176.141 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -130.89 133.72 62.69 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 C-N-CA 124.915 1.286 . . . . 0.0 110.483 175.671 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 73.4 t -64.15 134.34 29.04 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 C-N-CA 124.168 0.987 . . . . 0.0 110.405 -178.152 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 59.0 t -70.97 116.5 47.07 Favored Pre-proline 0 CA--C 1.544 0.739 0 CA-C-O 118.627 -0.702 . . . . 0.0 109.467 173.741 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -83.37 154.8 14.21 Favored 'Trans proline' 0 N--CA 1.457 -0.642 0 C-N-CA 123.546 2.831 . . . . 0.0 111.607 179.949 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 3.9 pm0 -64.37 -22.39 66.94 Favored 'General case' 0 N--CA 1.471 0.577 0 O-C-N 121.089 -1.007 . . . . 0.0 112.675 174.435 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 67.6 p -71.85 -17.65 62.12 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 125.131 1.372 . . . . 0.0 113.064 175.936 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 61.0 p -74.05 -35.53 64.29 Favored 'General case' 0 N--CA 1.48 1.066 0 CA-C-N 119.278 0.945 . . . . 0.0 112.177 175.811 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 57.3 tt0 59.76 -49.17 0.08 Allowed 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 129.94 3.296 . . . . 0.0 115.994 -177.366 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 71.8 m-20 -80.23 -11.15 59.76 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.6 1.56 . . . . 0.0 113.883 177.719 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 63.5 mtp 57.59 27.19 13.8 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 125.889 1.675 . . . . 0.0 114.517 -179.3 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -145.83 147.65 32.05 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.327 1.051 . . . . 0.0 113.483 -175.421 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 40.2 m-85 -149.79 164.97 33.87 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 127.051 2.14 . . . . 0.0 110.276 175.304 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 38.1 ttmt -114.09 132.04 56.18 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 124.496 1.119 . . . . 0.0 112.815 -177.881 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 13.1 t -66.94 112.67 10.34 Favored Pre-proline 0 CA--C 1.542 0.655 0 C-N-CA 126.284 1.834 . . . . 0.0 109.744 168.437 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -70.16 -18.87 34.84 Favored 'Trans proline' 0 CA--C 1.54 0.796 0 C-N-CA 122.5 2.134 . . . . 0.0 113.024 176.494 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 36.5 mt -70.93 -50.11 45.32 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 C-N-CA 124.839 1.256 . . . . 0.0 110.968 -175.886 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 15.6 p -108.55 -2.09 19.15 Favored 'General case' 0 CA--C 1.552 1.028 0 C-N-CA 124.906 1.283 . . . . 0.0 113.607 178.425 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 568' ' ' LYS . . . . . . . . . . . . . 96.0 mttt 60.44 46.59 9.63 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 126.913 2.085 . . . . 0.0 112.697 -177.507 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 72.1 mm-40 -126.04 141.88 51.76 Favored 'General case' 0 N--CA 1.481 1.078 0 N-CA-C 114.688 1.366 . . . . 0.0 114.688 -176.975 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 93.7 m -86.23 130.56 34.48 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 123.781 0.832 . . . . 0.0 112.979 -176.535 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 3.0 m -94.78 151.43 3.82 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.891 0 C-N-CA 125.779 1.631 . . . . 0.0 111.088 167.514 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 65.8 p -134.15 149.52 51.05 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 125.414 1.486 . . . . 0.0 111.27 178.158 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -67.69 143.8 42.67 Favored Glycine 0 CA--C 1.536 1.363 0 C-N-CA 124.219 0.914 . . . . 0.0 114.868 -177.42 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 98.8 t -139.67 136.0 39.51 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 125.596 1.558 . . . . 0.0 112.091 -179.703 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 75.2 t80 -73.25 123.58 23.99 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 120.241 1.382 . . . . 0.0 112.97 -177.262 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 16.1 t0 -91.62 123.01 34.7 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 125.641 1.576 . . . . 0.0 111.274 169.979 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -72.37 -24.59 61.29 Favored 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 114.131 1.16 . . . . 0.0 114.131 177.125 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -73.84 -53.74 9.55 Favored 'General case' 0 N--CA 1.476 0.826 0 CA-C-N 119.09 0.859 . . . . 0.0 111.661 -176.299 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 15.4 t -78.6 -27.46 45.55 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 123.831 0.853 . . . . 0.0 112.201 172.749 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 79.45 32.54 37.83 Favored Glycine 0 CA--C 1.532 1.144 0 C-N-CA 124.032 0.825 . . . . 0.0 113.2 -175.754 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 77.6 mm-40 -141.49 155.92 45.79 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.73 1.612 . . . . 0.0 111.777 -170.421 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 79.7 m95 -76.08 138.32 40.74 Favored 'General case' 0 CA--C 1.534 0.358 0 O-C-N 120.967 -1.083 . . . . 0.0 111.468 173.584 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 18.7 m -138.8 151.03 23.62 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.019 0 C-N-CA 126.657 1.983 . . . . 0.0 113.002 -173.273 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 4.3 m0 -94.93 104.19 16.07 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 126.376 1.87 . . . . 0.0 108.639 168.632 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 53.9 mtmt -69.5 145.87 52.34 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 124.305 1.042 . . . . 0.0 111.443 -177.487 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 48.0 t30 48.96 44.76 22.65 Favored 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 125.326 1.45 . . . . 0.0 112.194 -178.236 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 87.9 m -131.77 146.35 52.1 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 124.528 1.131 . . . . 0.0 111.993 -173.058 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 13.0 tt -139.66 151.79 22.53 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.724 0 C-N-CA 127.967 2.507 . . . . 0.0 109.979 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 81.0 tt0 -107.93 117.77 35.01 Favored 'General case' 0 N--CA 1.472 0.67 0 O-C-N 120.889 -1.132 . . . . 0.0 110.734 172.099 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 5.0 t -144.18 138.38 24.13 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 C-N-CA 125.511 1.524 . . . . 0.0 110.506 -175.567 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 14.5 m120 54.39 34.49 20.9 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 124.973 1.309 . . . . 0.0 113.678 -179.57 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 75.77 11.27 84.68 Favored Glycine 0 CA--C 1.536 1.4 0 C-N-CA 124.773 1.178 . . . . 0.0 115.58 -179.329 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 64.1 mttp -132.21 157.08 45.24 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 125.96 1.704 . . . . 0.0 111.614 -179.298 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 74.8 m-85 -88.38 130.97 35.02 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 121.685 0.755 . . . . 0.0 111.566 174.241 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 12.1 m-30 -124.72 156.68 37.25 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 127.104 2.162 . . . . 0.0 109.696 -176.523 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 596' ' ' HIS . . . . . 0.406 ' HB2' ' HB2' ' A' ' 599' ' ' CYS . 29.6 m80 -79.87 140.98 36.55 Favored 'General case' 0 N--CA 1.47 0.573 0 O-C-N 120.837 -1.164 . . . . 0.0 108.184 167.085 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 19.1 m -66.8 -38.31 86.26 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 118.841 0.746 . . . . 0.0 112.262 -179.251 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 23.4 p -65.65 -37.86 87.72 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 123.872 0.869 . . . . 0.0 113.187 172.042 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 599' ' ' CYS . . . . . 0.406 ' HB2' ' HB2' ' A' ' 596' ' ' HIS . 68.0 m -61.71 -58.63 7.28 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 123.881 0.872 . . . . 0.0 110.089 172.7 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 58.1 t80 -53.48 -39.64 64.69 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 125.329 1.452 . . . . 0.0 113.517 -179.782 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 82.1 t60 -60.79 -27.16 67.81 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 113.85 1.056 . . . . 0.0 113.85 177.619 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 57.7 mm-40 -109.36 -7.95 15.14 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 125.571 1.549 . . . . 0.0 114.258 -179.958 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 19.3 m -66.94 -36.78 83.0 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 124.572 1.149 . . . . 0.0 113.082 -173.857 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 604' ' ' SER . . . . . . . . . . . . . 12.5 t -152.31 166.5 31.62 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 124.092 0.957 . . . . 0.0 112.325 179.678 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 605' ' ' GLN . . . . . . . . . . . . . 29.5 pt20 -60.54 149.4 34.71 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.79 1.236 . . . . 0.0 112.471 174.456 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 606' ' ' ASN . . . . . . . . . . . . . 28.1 m120 -79.78 -88.95 0.06 Allowed 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 123.848 0.859 . . . . 0.0 112.379 -174.529 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 607' ' ' SER . . . . . . . . . . . . . 37.0 m 53.89 -164.2 0.1 Allowed 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 125.328 1.451 . . . . 0.0 113.626 -175.539 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 608' ' ' SER . . . . . . . . . . . . . 80.8 p . . . . . 0 C--O 1.253 1.288 0 C-N-CA 126.562 1.945 . . . . 0.0 113.059 178.111 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 533' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.486 0 N-CA-C 111.117 -0.793 . . . . 0.0 111.117 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . -69.86 166.72 49.26 Favored Glycine 0 CA--C 1.537 1.426 0 C-N-CA 124.091 0.853 . . . . 0.0 113.909 175.768 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 535' ' ' SER . . . . . . . . . . . . . 21.9 m -63.46 137.84 58.29 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.55 1.14 . . . . 0.0 112.871 -178.229 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 536' ' ' GLU . . . . . . . . . . . . . 24.0 tp10 -152.46 128.24 10.2 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 125.819 1.648 . . . . 0.0 109.21 175.689 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 537' ' ' PHE . . . . . . . . . . . . . 70.0 t80 -72.65 127.52 32.8 Favored 'General case' 0 CA--C 1.54 0.594 0 N-CA-C 113.053 0.76 . . . . 0.0 113.053 -171.581 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 22.7 t -160.75 50.26 0.26 Allowed 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 126.504 1.921 . . . . 0.0 108.766 171.907 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 539' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -129.06 179.09 5.95 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 125.484 1.513 . . . . 0.0 113.882 -167.257 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 540' ' ' ARG . . . . . . . . . . . . . 62.5 mtp85 63.96 4.0 1.85 Allowed 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 127.531 2.332 . . . . 0.0 116.642 175.41 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 45.7 m -65.99 160.01 24.57 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.977 1.311 . . . . 0.0 112.02 169.439 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 542' ' ' ASN . . . . . . . . . . . . . 16.2 p-10 -59.58 -23.94 63.35 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 113.673 0.99 . . . . 0.0 113.673 176.795 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 52.7 mt-10 -55.46 -30.94 61.48 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.608 1.163 . . . . 0.0 112.824 175.348 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 10.0 mp -59.66 -36.17 75.88 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 119.321 0.964 . . . . 0.0 111.793 175.773 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 82.2 mm-40 -84.66 -43.8 14.03 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 123.619 0.768 . . . . 0.0 112.818 178.511 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 34.9 mm -69.1 -28.29 38.57 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.835 0 O-C-N 121.914 -0.491 . . . . 0.0 111.824 -178.25 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . 0.269 0.0 OUTLIER -76.27 -13.94 60.14 Favored 'General case' 0 N--CA 1.486 1.347 0 O-C-N 120.505 -1.372 . . . . 0.0 113.54 175.856 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -70.6 -12.95 70.91 Favored Glycine 0 CA--C 1.537 1.414 0 C-N-CA 124.751 1.167 . . . . 0.0 113.9 170.914 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 32.0 mmtp -75.03 127.6 33.61 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 118.767 1.283 . . . . 0.0 110.364 171.245 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 39.9 p90 -149.62 164.24 35.68 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 123.854 0.861 . . . . 0.0 112.713 173.737 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -134.24 133.15 55.63 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 C-N-CA 126.15 1.78 . . . . 0.0 109.644 174.634 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 53.8 t -67.23 135.28 28.83 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.94 0 C-N-CA 123.774 0.83 . . . . 0.0 110.834 -176.72 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 19.0 t -74.28 116.21 50.58 Favored Pre-proline 0 N--CA 1.474 0.729 0 N-CA-C 108.518 -0.919 . . . . 0.0 108.518 171.523 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_endo -77.05 151.13 30.33 Favored 'Trans proline' 0 N--CA 1.458 -0.586 0 C-N-CA 122.752 2.301 . . . . 0.0 111.302 175.456 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -62.65 -22.36 66.38 Favored 'General case' 0 N--CA 1.477 0.876 0 O-C-N 121.376 -0.827 . . . . 0.0 112.942 175.069 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 20.6 m -64.32 -28.32 69.63 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 125.353 1.461 . . . . 0.0 113.487 171.685 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 42.3 t -78.14 125.97 30.13 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 123.934 0.894 . . . . 0.0 112.181 179.639 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 1.7 pm0 -81.31 152.66 27.45 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.363 1.065 . . . . 0.0 111.868 170.197 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 36.3 m-20 60.75 -11.93 0.05 OUTLIER 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 127.642 2.377 . . . . 0.0 117.365 176.848 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 46.9 mtp 57.34 32.76 22.29 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 126.098 1.759 . . . . 0.0 114.194 173.448 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -151.33 155.54 38.92 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.827 1.251 . . . . 0.0 112.797 -171.674 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -152.97 154.44 34.99 Favored 'General case' 0 CA--C 1.542 0.673 0 N-CA-C 113.09 0.774 . . . . 0.0 113.09 173.237 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 14.5 tptm -77.88 142.0 38.74 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 125.107 1.363 . . . . 0.0 113.226 -178.116 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 14.8 t -94.45 107.25 28.47 Favored Pre-proline 0 CA--C 1.539 0.554 0 C-N-CA 125.165 1.386 . . . . 0.0 108.979 167.736 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 63.9 Cg_endo -67.66 -19.58 47.67 Favored 'Trans proline' 0 CA--C 1.542 0.905 0 C-N-CA 122.162 1.908 . . . . 0.0 113.529 175.851 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 89.0 mt -73.48 -56.86 8.12 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 C-N-CA 124.365 1.066 . . . . 0.0 111.178 -176.473 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 14.9 p -100.17 0.3 40.25 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 124.488 1.115 . . . . 0.0 113.794 179.242 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 568' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 59.58 44.32 14.73 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 126.818 2.047 . . . . 0.0 112.122 -179.423 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 74.7 mm-40 -115.59 -175.35 2.7 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 123.774 0.83 . . . . 0.0 112.154 179.857 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 60.6 m -125.6 128.66 48.24 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 124.403 1.081 . . . . 0.0 110.586 172.078 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 2.3 p -91.83 147.15 5.49 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 C-N-CA 124.357 1.063 . . . . 0.0 111.062 170.161 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 64.3 p -133.4 145.91 50.74 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 124.826 1.25 . . . . 0.0 111.753 -175.299 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -72.04 153.6 49.98 Favored Glycine 0 CA--C 1.537 1.413 0 C-N-CA 124.275 0.941 . . . . 0.0 113.63 -179.939 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 8.8 p -142.69 138.06 28.13 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 C-N-CA 124.362 1.065 . . . . 0.0 112.383 177.972 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 68.9 t80 -71.71 118.37 14.46 Favored 'General case' 0 CA--C 1.544 0.732 0 O-C-N 121.497 -0.752 . . . . 0.0 112.295 -178.364 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 21.8 t0 -85.22 120.9 27.23 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.32 1.048 . . . . 0.0 110.493 170.158 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 53.2 mt-10 -74.36 -22.91 59.0 Favored 'General case' 0 CA--C 1.54 0.565 0 N-CA-C 113.765 1.024 . . . . 0.0 113.765 -178.812 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 34.1 mm-40 -76.52 -51.17 12.22 Favored 'General case' 0 N--CA 1.476 0.849 0 CA-C-N 119.467 1.03 . . . . 0.0 112.998 177.203 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 15.7 t -75.07 -27.44 59.94 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 123.47 0.708 . . . . 0.0 112.071 173.736 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 75.49 32.18 55.32 Favored Glycine 0 CA--C 1.535 1.324 0 C-N-CA 124.829 1.204 . . . . 0.0 112.655 -175.002 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -143.94 150.44 38.35 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 125.506 1.522 . . . . 0.0 112.133 -170.863 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 84.7 m95 -73.71 138.97 45.0 Favored 'General case' 0 CA--C 1.537 0.474 0 O-C-N 121.288 -0.883 . . . . 0.0 111.904 175.429 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 5.5 m -134.84 141.58 42.72 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 C-N-CA 126.115 1.766 . . . . 0.0 112.9 -177.419 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 4.7 m0 -87.51 102.94 15.06 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.739 1.616 . . . . 0.0 108.854 169.338 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 73.5 mmtt -72.8 147.54 45.4 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 123.867 0.867 . . . . 0.0 111.628 -178.581 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 51.3 t30 50.45 43.76 27.0 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.959 1.304 . . . . 0.0 112.271 -177.983 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 93.0 m -126.2 147.19 49.71 Favored 'General case' 0 N--CA 1.48 1.057 0 O-C-N 120.774 -1.203 . . . . 0.0 112.899 -172.095 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 5.6 tt -139.65 144.87 27.75 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.672 0 C-N-CA 127.663 2.385 . . . . 0.0 109.668 179.964 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 87.0 tt0 -117.46 121.04 39.96 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 124.977 1.311 . . . . 0.0 110.198 173.47 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 5.2 t -142.88 131.16 19.96 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.509 0 C-N-CA 125.96 1.704 . . . . 0.0 109.746 -175.164 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 71.5 m-20 52.22 44.72 29.45 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 125.223 1.409 . . . . 0.0 112.737 174.953 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 73.33 9.85 77.93 Favored Glycine 0 CA--C 1.536 1.363 0 C-N-CA 125.157 1.36 . . . . 0.0 115.507 178.915 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 35.9 mtmm -128.58 151.86 48.97 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 126.085 1.754 . . . . 0.0 112.007 -176.415 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 69.4 m-85 -96.72 148.59 22.73 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 124.098 0.959 . . . . 0.0 112.88 174.211 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 65.3 m-85 -149.13 160.1 43.65 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.177 1.391 . . . . 0.0 110.578 177.748 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 596' ' ' HIS . . . . . . . . . . . . . 20.8 m170 -75.19 142.23 43.5 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 167.628 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 8.7 t -67.54 -42.23 83.0 Favored 'General case' 0 N--CA 1.469 0.505 0 O-C-N 121.388 -0.82 . . . . 0.0 111.867 -179.273 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 21.6 p -60.32 -38.76 84.74 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.661 0.785 . . . . 0.0 113.096 173.471 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 599' ' ' CYS . . . . . . . . . . . . . 95.1 m -68.35 -57.61 5.65 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.161 0.984 . . . . 0.0 110.727 177.385 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 54.7 t80 -65.56 -33.51 76.09 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 113.064 0.764 . . . . 0.0 113.064 -175.246 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 82.0 t60 -58.18 -36.88 73.71 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 124.742 1.217 . . . . 0.0 113.108 175.315 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 94.8 mt-10 -89.78 -26.26 20.68 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 113.648 0.981 . . . . 0.0 113.648 176.329 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 83.0 m -84.71 -37.02 21.44 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.121 0.968 . . . . 0.0 113.096 -175.037 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 604' ' ' SER . . . . . . . . . . . . . 80.6 p -63.75 149.97 45.57 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-O 121.349 0.595 . . . . 0.0 111.162 170.535 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 605' ' ' GLN . . . . . . . . . . . . . 19.3 pt20 -63.57 147.5 51.29 Favored 'General case' 0 N--CA 1.474 0.738 0 O-C-N 121.525 -0.734 . . . . 0.0 112.329 -176.478 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 606' ' ' ASN . . . . . . . . . . . . . 22.3 t-20 -62.57 131.85 50.45 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 123.748 0.819 . . . . 0.0 112.434 -174.246 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 607' ' ' SER . . . . . . . . . . . . . 80.1 p -109.54 1.59 19.84 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 126.207 1.803 . . . . 0.0 114.274 -177.053 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 608' ' ' SER . . . . . . . . . . . . . 26.1 m . . . . . 0 C--O 1.255 1.367 0 C-N-CA 126.09 1.756 . . . . 0.0 114.007 -177.794 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 533' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.601 0 N-CA-C 110.993 -0.843 . . . . 0.0 110.993 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . -164.27 24.4 0.18 Allowed Glycine 0 CA--C 1.538 1.505 0 C-N-CA 124.277 0.942 . . . . 0.0 114.513 -176.638 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 535' ' ' SER . . . . . . . . . . . . . 86.6 p -159.07 167.32 29.54 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 125.91 1.684 . . . . 0.0 111.467 -173.586 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 536' ' ' GLU . . . . . . . . . . . . 0.26 6.6 pt-20 58.17 -4.2 0.06 Allowed 'General case' 0 N--CA 1.483 1.179 0 N-CA-C 119.119 3.007 . . . . 0.0 119.119 171.32 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 537' ' ' PHE . . . . . . . . . . . . . 9.5 p90 -143.05 -176.28 4.85 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 125.043 1.337 . . . . 0.0 112.606 174.34 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 14.8 m -49.23 150.14 1.83 Allowed 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 127.15 2.18 . . . . 0.0 115.139 -174.717 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 539' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -61.2 -14.53 26.18 Favored 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 116.379 1.992 . . . . 0.0 116.379 -169.008 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 540' ' ' ARG . . . . . . . . . . . . . 3.3 mmp_? -54.37 -39.17 66.92 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 124.702 1.201 . . . . 0.0 112.702 172.865 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 23.5 m 54.42 -63.85 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 128.972 2.909 . . . . 0.0 117.907 171.331 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 542' ' ' ASN . . . . . . . . . . . . . 78.2 m-20 -72.97 -13.38 61.23 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 126.173 1.789 . . . . 0.0 114.934 -169.11 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 14.8 pt-20 -57.35 -27.49 62.3 Favored 'General case' 0 CA--C 1.547 0.849 0 CA-C-N 120.185 1.357 . . . . 0.0 114.019 -174.384 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 76.6 mt -74.34 -15.96 60.93 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 125.199 1.4 . . . . 0.0 113.631 175.679 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -107.95 -32.17 7.68 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 126.466 1.906 . . . . 0.0 112.49 178.584 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 5.9 mm -52.54 -42.32 39.4 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.928 0 C-N-CA 125.44 1.496 . . . . 0.0 111.212 173.79 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 38.4 ptt180 -64.4 -22.68 67.03 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 125.145 1.378 . . . . 0.0 114.148 176.816 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -81.25 -9.36 86.11 Favored Glycine 0 CA--C 1.533 1.164 0 C-N-CA 125.63 1.586 . . . . 0.0 114.47 -177.597 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -70.45 143.62 51.72 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 118.348 1.074 . . . . 0.0 110.684 173.336 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 38.9 p90 -151.46 165.68 33.44 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 124.09 0.956 . . . . 0.0 112.528 177.576 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -131.16 134.14 61.68 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 C-N-CA 125.612 1.565 . . . . 0.0 110.137 174.326 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 10.8 p -70.6 133.67 31.43 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 C-N-CA 123.723 0.809 . . . . 0.0 110.965 -176.164 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 5.1 t -85.24 120.26 73.18 Favored Pre-proline 0 C--O 1.238 0.493 0 C-N-CA 125.101 1.36 . . . . 0.0 110.321 173.824 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -76.5 146.25 27.29 Favored 'Trans proline' 0 C--N 1.352 0.713 0 C-N-CA 122.28 1.987 . . . . 0.0 111.146 169.583 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -62.92 -23.49 67.39 Favored 'General case' 0 N--CA 1.476 0.858 0 O-C-N 121.444 -0.785 . . . . 0.0 112.794 179.283 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 67.7 p -68.73 -18.23 64.2 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 125.49 1.516 . . . . 0.0 113.934 172.851 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 15.3 t -74.99 43.17 0.2 Allowed 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 124.881 1.272 . . . . 0.0 114.271 174.758 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 55.6 tt0 46.84 -99.13 0.04 OUTLIER 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 127.841 2.456 . . . . 0.0 114.226 170.121 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 79.7 m-20 -94.79 4.66 53.56 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 125.719 1.607 . . . . 0.0 114.712 -174.741 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 13.9 mtt 57.98 36.99 26.63 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 124.891 1.277 . . . . 0.0 114.083 -179.811 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -138.76 152.51 47.99 Favored 'General case' 0 CA--C 1.54 0.589 0 O-C-N 120.713 -1.242 . . . . 0.0 114.277 -176.584 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 17.6 t80 -151.06 174.15 13.52 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 126.139 1.776 . . . . 0.0 109.391 172.615 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 7.0 ttpm? -125.0 129.51 50.46 Favored 'General case' 0 N--CA 1.481 1.106 0 CA-C-N 120.702 1.592 . . . . 0.0 112.846 179.222 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 49.0 t -65.07 117.79 42.97 Favored Pre-proline 0 CA--C 1.538 0.482 0 C-N-CA 126.521 1.928 . . . . 0.0 111.032 172.778 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -63.96 -27.33 66.43 Favored 'Trans proline' 0 CA--C 1.54 0.791 0 C-N-CA 123.037 2.492 . . . . 0.0 115.114 176.437 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 97.0 mt -74.44 -55.18 12.83 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 124.174 0.989 . . . . 0.0 111.606 -172.492 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 15.3 p -100.74 -0.18 37.72 Favored 'General case' 0 CA--C 1.553 1.059 0 C-N-CA 124.287 1.035 . . . . 0.0 113.449 179.41 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 568' ' ' LYS . . . . . . . . . . . . . 1.6 mptp? 59.3 44.37 15.5 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 126.351 1.86 . . . . 0.0 112.041 -179.448 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 64.8 mm-40 -118.09 135.84 53.95 Favored 'General case' 0 N--CA 1.481 1.121 0 N-CA-C 114.312 1.227 . . . . 0.0 114.312 -173.954 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 94.0 m -76.13 116.11 16.51 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 123.427 0.691 . . . . 0.0 111.486 179.738 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 4.8 p -83.42 144.01 10.85 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.706 0 C-N-CA 124.49 1.116 . . . . 0.0 109.558 168.342 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 58.6 p -131.53 145.19 51.62 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 124.823 1.249 . . . . 0.0 110.692 178.82 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -68.7 138.01 31.21 Favored Glycine 0 CA--C 1.529 0.922 0 C-N-CA 124.327 0.965 . . . . 0.0 112.152 178.958 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 83.9 t -127.26 140.95 47.65 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.595 0 C-N-CA 124.583 1.153 . . . . 0.0 111.213 -176.586 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 65.9 t80 -64.91 124.2 21.42 Favored 'General case' 0 CA--C 1.545 0.784 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 -174.051 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 65.1 t0 -87.54 99.11 11.79 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 126.57 1.948 . . . . 0.0 109.803 172.269 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 -64.65 -24.45 67.59 Favored 'General case' 0 N--CA 1.473 0.712 0 N-CA-C 114.402 1.26 . . . . 0.0 114.402 -174.745 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 35.5 tp10 -75.34 -53.36 8.87 Favored 'General case' 0 N--CA 1.471 0.598 0 O-C-N 121.383 -0.823 . . . . 0.0 112.395 -179.187 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 65.2 m -87.74 -21.47 25.15 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 124.276 1.03 . . . . 0.0 113.189 179.5 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 79.91 30.35 43.42 Favored Glycine 0 CA--C 1.533 1.166 0 C-N-CA 124.712 1.149 . . . . 0.0 112.992 -175.382 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 79.2 mm-40 -111.33 -167.46 1.18 Allowed 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 125.861 1.664 . . . . 0.0 110.87 -177.5 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 73.3 m95 -125.41 145.89 49.86 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 125.399 1.48 . . . . 0.0 110.022 171.981 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 16.4 m -139.41 143.71 30.45 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.057 0 C-N-CA 124.838 1.255 . . . . 0.0 113.12 -172.135 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 12.3 m0 -94.35 102.05 14.03 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 126.036 1.735 . . . . 0.0 108.999 170.463 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 53.5 mtmt -74.14 151.13 40.13 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 125.828 1.651 . . . . 0.0 112.61 -177.275 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 54.3 t30 49.89 38.28 15.65 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 125.443 1.497 . . . . 0.0 112.825 -176.134 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 97.2 m -118.66 140.53 49.77 Favored 'General case' 0 N--CA 1.48 1.07 0 O-C-N 121.136 -0.978 . . . . 0.0 112.942 -172.212 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 14.0 tt -132.45 145.49 34.45 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.534 0 C-N-CA 127.729 2.412 . . . . 0.0 110.12 177.737 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 78.7 tt0 -108.86 131.99 54.46 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 124.861 1.264 . . . . 0.0 110.776 170.198 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 7.1 p -152.66 140.32 13.61 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 C-N-CA 124.786 1.235 . . . . 0.0 110.707 176.51 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 60.2 t30 53.4 37.68 26.1 Favored 'General case' 0 CA--C 1.553 1.084 0 C-N-CA 124.695 1.198 . . . . 0.0 113.21 179.268 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 73.35 10.2 78.49 Favored Glycine 0 CA--C 1.545 1.919 0 C-N-CA 124.828 1.204 . . . . 0.0 115.605 -179.678 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 55.4 mtmt -130.96 154.11 48.48 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 125.767 1.627 . . . . 0.0 111.979 -176.313 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 68.8 m-85 -92.91 149.56 21.17 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-O 121.949 0.88 . . . . 0.0 113.18 176.211 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -149.08 165.29 32.16 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 126.873 2.069 . . . . 0.0 109.489 -179.622 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 596' ' ' HIS . . . . . . . . . . . . . 26.1 m80 -83.52 141.49 31.59 Favored 'General case' 0 N--CA 1.467 0.388 0 O-C-N 121.68 -0.638 . . . . 0.0 109.58 168.424 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 15.3 m -64.93 -43.06 94.0 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 112.251 0.463 . . . . 0.0 112.251 -177.137 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 40.4 p -67.91 -41.75 82.19 Favored 'General case' 0 N--CA 1.481 1.104 0 N-CA-C 112.953 0.724 . . . . 0.0 112.953 175.769 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 599' ' ' CYS . . . . . . . . . . . . . 89.1 m -56.56 -54.37 46.69 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.489 1.116 . . . . 0.0 110.999 173.347 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 71.5 t80 -57.26 -45.06 84.36 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.166 0.987 . . . . 0.0 111.972 177.144 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 86.5 t60 -62.25 -42.53 99.4 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 114.071 1.137 . . . . 0.0 114.071 -179.194 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 75.1 mm-40 -80.21 -30.87 38.71 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 113.93 1.085 . . . . 0.0 113.93 177.186 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 86.6 m -93.92 -44.36 8.12 Favored 'General case' 0 N--CA 1.484 1.253 0 N-CA-C 113.357 0.873 . . . . 0.0 113.357 -171.842 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 604' ' ' SER . . . . . . . . . . . . . 19.5 m -95.02 38.33 1.13 Allowed 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.461 1.505 . . . . 0.0 113.704 -169.138 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 605' ' ' GLN . . . . . . . . . . . . . 55.4 tp60 -61.9 129.98 43.48 Favored 'General case' 0 CA--C 1.545 0.782 0 O-C-N 121.202 -0.936 . . . . 0.0 111.537 176.146 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 606' ' ' ASN . . . . . . . . . . . . . 8.7 p-10 -69.77 158.8 34.75 Favored 'General case' 0 CA--C 1.544 0.741 0 N-CA-C 114.502 1.297 . . . . 0.0 114.502 -177.654 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 607' ' ' SER . . . . . . . . . . . . . 50.8 m -78.46 161.24 27.24 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 124.535 1.134 . . . . 0.0 110.965 167.099 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 608' ' ' SER . . . . . . . . . . . . . 34.4 m . . . . . 0 C--O 1.254 1.331 0 C-N-CA 126.261 1.824 . . . . 0.0 114.151 175.856 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 533' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.46 0 N-CA-C 111.229 -0.749 . . . . 0.0 111.229 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . -79.63 -167.5 34.69 Favored Glycine 0 CA--C 1.54 1.612 0 C-N-CA 124.687 1.137 . . . . 0.0 114.547 177.329 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 535' ' ' SER . . . . . . . . . . . . . 33.6 t -148.09 142.77 26.62 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 125.876 1.67 . . . . 0.0 110.943 177.784 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 536' ' ' GLU . . . . . . . . . . . . . 56.2 mp0 -74.02 135.05 43.09 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.457 1.103 . . . . 0.0 113.106 -175.856 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 537' ' ' PHE . . . . . . . . . . . . . 52.7 p90 -156.73 175.82 13.55 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 126.301 1.84 . . . . 0.0 110.628 171.365 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 21.7 t -140.42 168.74 19.1 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.859 1.264 . . . . 0.0 112.426 -178.714 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 539' ' ' ASP . . . . . . . . . . . . . 67.3 m-20 -73.64 12.21 0.68 Allowed 'General case' 0 CA--C 1.55 0.965 0 C-N-CA 126.305 1.842 . . . . 0.0 114.867 -174.336 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 540' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 -63.08 -12.97 30.54 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 125.488 1.515 . . . . 0.0 113.745 173.924 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 81.0 p -56.69 -25.55 54.38 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 125.648 1.579 . . . . 0.0 114.546 -177.139 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 542' ' ' ASN . . . . . . . . . . . . . 29.0 m120 -62.99 -23.68 67.56 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-N 119.801 1.182 . . . . 0.0 113.485 175.346 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 85.8 mt-10 -63.48 -39.94 95.79 Favored 'General case' 0 N--CA 1.474 0.766 0 O-C-N 120.701 -1.25 . . . . 0.0 112.443 178.168 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -69.63 -27.99 65.53 Favored 'General case' 0 N--CA 1.471 0.595 0 O-C-N 121.42 -0.8 . . . . 0.0 112.047 176.92 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 57.7 mt-10 -71.4 -40.76 70.31 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 123.583 0.753 . . . . 0.0 112.186 174.57 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 31.4 mm -63.14 -37.29 79.01 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 C-N-CA 123.415 0.686 . . . . 0.0 111.022 172.17 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -69.93 -28.5 65.63 Favored 'General case' 0 N--CA 1.481 1.083 0 O-C-N 121.459 -0.775 . . . . 0.0 112.444 174.58 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -76.45 -9.08 86.08 Favored Glycine 0 CA--C 1.539 1.536 0 C-N-CA 125.435 1.493 . . . . 0.0 115.042 176.623 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 9.7 mmpt? -67.19 141.41 57.33 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-N 119.477 1.639 . . . . 0.0 111.14 172.349 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 51.5 p90 -153.79 164.83 37.68 Favored 'General case' 0 C--O 1.24 0.563 0 C-N-CA 124.354 1.062 . . . . 0.0 112.27 170.854 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 6.5 m -129.74 137.15 57.43 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 C-N-CA 126.19 1.796 . . . . 0.0 108.971 169.493 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 9.2 p -66.49 134.84 29.46 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.923 0 O-C-N 121.167 -0.958 . . . . 0.0 110.043 -179.312 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 3.3 t -88.09 114.55 59.82 Favored Pre-proline 0 CA--C 1.54 0.567 0 C-N-CA 123.68 0.792 . . . . 0.0 109.112 174.564 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 95.5 Cg_endo -74.29 162.97 37.45 Favored 'Trans proline' 0 CA--C 1.534 0.503 0 C-N-CA 122.704 2.269 . . . . 0.0 112.937 -178.826 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 17.1 pt-20 -66.0 -19.56 65.9 Favored 'General case' 0 N--CA 1.477 0.904 0 O-C-N 121.318 -0.864 . . . . 0.0 113.022 172.148 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 76.7 p -80.91 -6.07 58.22 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 126.057 1.743 . . . . 0.0 113.685 172.103 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 44.1 t -60.28 148.02 38.19 Favored 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 114.333 1.234 . . . . 0.0 114.333 -179.168 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 7.2 pt20 -74.32 88.05 2.03 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.953 1.301 . . . . 0.0 111.577 170.955 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 26.6 m-20 56.33 19.28 3.88 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 126.479 1.912 . . . . 0.0 115.175 176.313 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 10.5 mtt 55.75 30.98 16.63 Favored 'General case' 0 N--CA 1.472 0.625 0 N-CA-C 115.259 1.577 . . . . 0.0 115.259 -174.217 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -133.92 139.28 46.04 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.304 1.042 . . . . 0.0 112.637 -178.713 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 5.7 t80 -154.31 159.49 41.25 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 123.361 0.665 . . . . 0.0 112.107 177.74 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -88.88 152.44 21.74 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 125.465 1.506 . . . . 0.0 114.106 -172.74 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 25.3 t -104.16 104.41 43.76 Favored Pre-proline 0 CA--C 1.547 0.863 0 C-N-CA 126.615 1.966 . . . . 0.0 109.347 166.117 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -62.16 -23.49 75.53 Favored 'Trans proline' 0 CA--C 1.54 0.803 0 C-N-CA 123.243 2.629 . . . . 0.0 115.258 178.314 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 79.0 mt -72.96 -54.52 15.59 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 C-N-CA 124.089 0.956 . . . . 0.0 111.044 -176.749 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 14.1 p -102.8 1.19 33.84 Favored 'General case' 0 CA--C 1.551 1.014 0 N-CA-C 113.807 1.04 . . . . 0.0 113.807 -178.409 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 568' ' ' LYS . . . . . . . . . . . . 0.304 0.0 OUTLIER 55.73 43.71 27.45 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 127.808 2.443 . . . . 0.0 113.688 -175.909 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 70.9 mm-40 -110.88 -177.58 3.25 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.096 0.558 . . . . 0.0 112.41 179.568 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 99.1 m -125.9 126.72 44.87 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 124.817 1.247 . . . . 0.0 111.346 177.793 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 1.2 m -87.61 144.7 8.69 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.775 0 C-N-CA 124.645 1.178 . . . . 0.0 110.61 168.681 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 51.4 p -130.63 144.1 51.19 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 124.42 1.088 . . . . 0.0 111.296 176.438 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -67.54 152.81 52.8 Favored Glycine 0 CA--C 1.535 1.294 0 C-N-CA 124.201 0.905 . . . . 0.0 113.845 179.715 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 8.9 p -137.6 142.08 37.53 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 C-N-CA 125.177 1.391 . . . . 0.0 112.14 176.345 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 75.6 t80 -77.21 123.11 25.99 Favored 'General case' 0 CA--C 1.542 0.667 0 O-C-N 120.618 -1.301 . . . . 0.0 112.984 -173.214 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 24.3 t0 -90.08 118.14 29.39 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 124.67 1.188 . . . . 0.0 111.427 169.217 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 63.2 mt-10 -71.84 -27.75 63.1 Favored 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 113.656 0.984 . . . . 0.0 113.656 -178.788 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -75.31 -50.27 16.56 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 123.797 0.839 . . . . 0.0 111.998 -178.398 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 13.0 t -74.18 -28.98 61.54 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.461 0.705 . . . . 0.0 112.268 171.933 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 76.57 29.35 58.0 Favored Glycine 0 CA--C 1.536 1.39 0 C-N-CA 123.651 0.643 . . . . 0.0 112.721 -174.905 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 79.4 mm-40 -141.65 157.48 45.03 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 125.454 1.501 . . . . 0.0 111.106 -173.154 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 75.7 m95 -79.63 146.62 32.41 Favored 'General case' 0 N--CA 1.47 0.554 0 O-C-N 121.157 -0.964 . . . . 0.0 112.007 177.359 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 8.5 m -135.05 138.89 48.22 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 C-N-CA 126.249 1.82 . . . . 0.0 112.433 -177.068 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 0.8 OUTLIER -90.4 100.21 13.09 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 126.062 1.745 . . . . 0.0 107.23 170.229 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 42.7 mtmt -75.48 150.32 38.25 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 123.861 0.864 . . . . 0.0 112.367 179.088 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 54.1 t30 51.45 40.23 26.26 Favored 'General case' 0 CA--C 1.551 1.01 0 C-N-CA 125.627 1.571 . . . . 0.0 112.43 -174.666 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 80.6 m -125.21 145.88 49.77 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 124.149 0.98 . . . . 0.0 112.895 -174.584 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 8.4 tt -142.81 148.16 20.0 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 C-N-CA 127.577 2.351 . . . . 0.0 110.743 -178.825 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 60.4 tt0 -110.38 126.15 53.97 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 125.24 1.416 . . . . 0.0 109.539 169.683 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 2.2 t -142.99 129.57 17.61 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 C-N-CA 126.322 1.849 . . . . 0.0 109.809 -177.041 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 70.1 m-20 52.78 37.09 22.97 Favored 'General case' 0 CA--C 1.551 1.01 0 C-N-CA 125.064 1.346 . . . . 0.0 114.073 174.39 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 79.59 8.21 87.91 Favored Glycine 0 CA--C 1.536 1.397 0 C-N-CA 124.853 1.216 . . . . 0.0 115.485 -179.557 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 56.6 mtmt -127.54 155.46 43.76 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 125.878 1.671 . . . . 0.0 111.408 178.029 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 65.6 m-85 -98.87 149.45 22.9 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 123.905 0.882 . . . . 0.0 112.424 175.996 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 93.5 m-85 -150.58 162.04 41.42 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 126.087 1.755 . . . . 0.0 111.547 -174.924 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 596' ' ' HIS . . . . . 0.402 ' HB2' ' HB2' ' A' ' 599' ' ' CYS . 18.3 m80 -74.69 141.01 44.57 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 166.935 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 9.2 t -65.09 -40.36 94.49 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 118.219 0.463 . . . . 0.0 111.504 177.471 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 21.4 p -60.67 -45.32 94.59 Favored 'General case' 0 N--CA 1.478 0.938 0 N-CA-C 114.062 1.134 . . . . 0.0 114.062 172.001 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 599' ' ' CYS . . . . . 0.402 ' HB2' ' HB2' ' A' ' 596' ' ' HIS . 98.9 m -62.13 -51.52 67.56 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 123.884 0.874 . . . . 0.0 111.837 177.551 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 68.5 t80 -61.27 -41.97 97.85 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 123.599 0.759 . . . . 0.0 112.012 177.659 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 23.8 t-80 -68.01 -35.14 77.79 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 123.886 0.875 . . . . 0.0 113.263 178.238 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 31.8 tp10 -69.8 -34.21 73.41 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 124.514 1.125 . . . . 0.0 112.384 172.161 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 95.8 m -70.28 -37.06 74.76 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 124.122 0.969 . . . . 0.0 111.765 173.513 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 604' ' ' SER . . . . . . . . . . . . . 52.3 m -73.23 170.1 15.69 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 126.123 1.769 . . . . 0.0 113.37 177.725 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 605' ' ' GLN . . . . . . . . . . . . . 77.0 mt-30 -136.4 163.79 29.64 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.583 1.553 . . . . 0.0 111.4 175.701 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 606' ' ' ASN . . . . . . . . . . . . . 42.6 t30 -67.16 169.18 8.98 Favored 'General case' 0 CA--C 1.554 1.108 0 C-N-CA 124.245 1.018 . . . . 0.0 111.866 171.025 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 607' ' ' SER . . . . . . . . . . . . . 30.8 t -53.8 134.11 42.41 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 124.804 1.242 . . . . 0.0 113.125 -177.297 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 608' ' ' SER . . . . . . . . . . . . . 31.4 t . . . . . 0 C--O 1.254 1.34 0 C-N-CA 126.337 1.855 . . . . 0.0 111.632 -172.963 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 533' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.628 0 N-CA-C 110.964 -0.854 . . . . 0.0 110.964 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . -80.8 -12.41 82.79 Favored Glycine 0 CA--C 1.538 1.512 0 N-CA-C 115.641 1.016 . . . . 0.0 115.641 -176.923 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 535' ' ' SER . . . . . . . . . . . . . 91.2 p -92.24 158.69 16.0 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 125.457 1.503 . . . . 0.0 113.764 -178.304 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 536' ' ' GLU . . . . . . . . . . . . . 17.2 pt-20 -93.92 11.76 28.39 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 126.115 1.766 . . . . 0.0 113.467 176.805 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 537' ' ' PHE . . . . . . . . . . . . . 10.0 m-30 -70.31 0.95 5.48 Favored 'General case' 0 CA--C 1.547 0.857 0 N-CA-C 116.595 2.072 . . . . 0.0 116.595 -167.879 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 38.2 t -149.41 -52.87 0.16 Allowed 'General case' 0 N--CA 1.478 0.927 0 CA-C-N 119.645 1.111 . . . . 0.0 113.546 174.778 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 539' ' ' ASP . . . . . . . . . . . . . 39.9 t0 52.34 43.4 30.85 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 124.665 1.186 . . . . 0.0 113.167 -178.324 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 540' ' ' ARG . . . . . . . . . . . . . 61.9 ttt180 -142.33 142.09 32.44 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 125.394 1.478 . . . . 0.0 111.941 -172.964 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 32.1 t -67.25 -28.66 68.23 Favored 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 114.553 1.316 . . . . 0.0 114.553 -169.837 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 542' ' ' ASN . . . . . . . . . . . . . 13.7 p-10 -61.03 -23.07 65.14 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 124.563 1.145 . . . . 0.0 114.087 -174.871 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -59.03 -32.21 69.53 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 124.333 1.053 . . . . 0.0 113.099 173.652 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 75.6 mt -78.48 -36.38 45.27 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 124.374 1.07 . . . . 0.0 112.415 178.613 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -67.25 -33.39 75.23 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 114.062 1.134 . . . . 0.0 114.062 -169.033 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 33.2 mm -62.94 -37.11 78.43 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.881 0 C-N-CA 123.107 0.563 . . . . 0.0 112.142 -176.912 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 547' ' ' ARG . . . . . 0.423 ' H ' ' HD2' ' A' ' 547' ' ' ARG . 0.0 OUTLIER -87.16 -8.99 56.36 Favored 'General case' 0 N--CA 1.48 1.038 0 N-CA-C 113.883 1.068 . . . . 0.0 113.883 177.988 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -77.69 -12.58 84.34 Favored Glycine 0 CA--C 1.537 1.447 0 C-N-CA 124.677 1.132 . . . . 0.0 114.523 170.301 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -69.75 135.33 49.62 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 118.769 1.284 . . . . 0.0 113.003 -178.462 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 42.7 p90 -154.74 162.82 40.97 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 124.737 1.215 . . . . 0.0 112.538 169.979 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -136.07 133.03 50.43 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.581 0 C-N-CA 126.246 1.819 . . . . 0.0 109.925 179.84 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 9.9 p -67.37 138.94 21.8 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.135 0 C-N-CA 123.633 0.773 . . . . 0.0 111.64 -175.868 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 61.6 t -76.24 115.74 49.77 Favored Pre-proline 0 N--CA 1.473 0.681 0 C-N-CA 124.53 1.132 . . . . 0.0 108.752 169.835 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -79.49 157.72 25.43 Favored 'Trans proline' 0 CA--C 1.54 0.791 0 C-N-CA 122.965 2.443 . . . . 0.0 111.972 176.914 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -64.63 -24.36 67.56 Favored 'General case' 0 CA--C 1.55 0.97 0 N-CA-C 113.414 0.894 . . . . 0.0 113.414 179.897 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 37.4 p -69.04 -37.36 78.55 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 125.557 1.543 . . . . 0.0 112.453 174.399 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 60.9 m -79.85 59.88 3.29 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.001 1.321 . . . . 0.0 111.046 171.267 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -65.7 -17.15 64.4 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 124.928 1.291 . . . . 0.0 114.131 -170.276 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 70.2 m-20 -73.85 -17.93 61.0 Favored 'General case' 0 N--CA 1.479 1.011 0 O-C-N 120.902 -1.124 . . . . 0.0 113.142 169.59 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 37.9 mtp 57.29 25.27 10.94 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 127.479 2.311 . . . . 0.0 115.102 176.886 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -140.96 152.82 45.28 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 124.319 1.048 . . . . 0.0 113.34 -175.073 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -156.1 160.66 40.14 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 126.45 1.9 . . . . 0.0 110.009 175.736 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 77.6 tttt -100.77 151.63 21.45 Favored 'General case' 0 N--CA 1.48 1.069 0 O-C-N 121.07 -1.019 . . . . 0.0 112.942 -179.455 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 49.0 t -92.22 110.27 43.33 Favored Pre-proline 0 CA--C 1.545 0.765 0 C-N-CA 127.374 2.27 . . . . 0.0 109.431 169.249 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -62.37 -15.37 44.63 Favored 'Trans proline' 0 CA--C 1.541 0.833 0 C-N-CA 123.919 3.08 . . . . 0.0 116.052 175.81 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 96.8 mt -80.05 -62.18 1.49 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.893 0 CA-C-N 119.311 0.959 . . . . 0.0 110.779 -179.239 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 14.7 p -96.96 -0.22 47.81 Favored 'General case' 0 CA--C 1.544 0.75 0 N-CA-C 113.947 1.092 . . . . 0.0 113.947 -177.521 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 568' ' ' LYS . . . . . . . . . . . . . 11.0 mptt 60.83 46.03 9.19 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 127.626 2.371 . . . . 0.0 111.707 -179.773 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 65.9 mm-40 -124.05 142.1 51.47 Favored 'General case' 0 N--CA 1.484 1.257 0 N-CA-C 114.947 1.462 . . . . 0.0 114.947 -175.085 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 88.4 m -87.71 122.41 31.35 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.794 0.838 . . . . 0.0 112.714 -177.42 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 2.9 m -81.98 151.13 4.27 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 C-N-CA 124.554 1.142 . . . . 0.0 110.007 167.243 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 57.6 p -131.96 147.97 52.49 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 124.728 1.211 . . . . 0.0 110.766 173.64 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -64.62 144.04 47.76 Favored Glycine 0 N--CA 1.468 0.825 0 C-N-CA 124.041 0.829 . . . . 0.0 113.775 -179.564 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 67.7 t -135.38 128.46 48.31 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.446 0 C-N-CA 125.575 1.55 . . . . 0.0 111.248 -179.52 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 88.3 t80 -67.59 115.72 7.5 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 121.687 -0.633 . . . . 0.0 112.278 -178.803 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -82.2 121.13 26.23 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 124.126 0.971 . . . . 0.0 110.234 169.888 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 53.0 mt-10 -70.72 -36.27 73.12 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.715 1.206 . . . . 0.0 113.841 -169.572 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -88.92 -33.93 17.1 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 119.041 0.837 . . . . 0.0 113.159 -178.586 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 19.3 m -72.24 -30.58 65.02 Favored 'General case' 0 N--CA 1.476 0.858 0 CA-C-N 118.421 0.555 . . . . 0.0 111.512 169.793 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 75.14 28.73 61.65 Favored Glycine 0 CA--C 1.535 1.289 0 C-N-CA 125.539 1.543 . . . . 0.0 113.562 -177.3 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 75.0 mm-40 -144.89 148.15 33.58 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 124.394 1.078 . . . . 0.0 112.246 -169.814 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 83.8 m95 -75.35 134.65 40.94 Favored 'General case' 0 C--N 1.327 -0.408 0 O-C-N 121.187 -0.946 . . . . 0.0 110.996 177.91 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 17.6 m -137.11 152.25 27.92 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 C-N-CA 126.359 1.864 . . . . 0.0 112.112 -173.704 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 5.8 m0 -93.96 102.64 14.74 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 126.011 1.724 . . . . 0.0 108.171 170.781 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 72.9 mmtt -78.12 145.44 35.73 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 124.408 1.083 . . . . 0.0 111.944 -178.431 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 60.08 37.64 20.93 Favored 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 125.097 1.359 . . . . 0.0 111.602 -175.691 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 26.8 m -128.7 149.02 50.86 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 124.783 1.233 . . . . 0.0 112.285 -171.222 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 17.3 tt -135.48 144.86 32.78 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 C-N-CA 127.507 2.323 . . . . 0.0 110.208 178.151 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 71.9 tt0 -106.15 125.63 51.23 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.478 1.111 . . . . 0.0 109.783 169.232 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 7.7 p -152.4 134.45 5.9 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.712 0 C-N-CA 124.589 1.155 . . . . 0.0 111.318 -175.826 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 70.9 m-20 53.27 35.29 19.73 Favored 'General case' 0 CA--C 1.553 1.093 0 C-N-CA 124.875 1.27 . . . . 0.0 114.266 -178.648 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 79.99 6.88 88.95 Favored Glycine 0 CA--C 1.538 1.529 0 C-N-CA 124.947 1.261 . . . . 0.0 115.64 179.727 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -130.43 158.39 40.03 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 125.388 1.475 . . . . 0.0 112.363 -179.383 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 78.3 m-85 -92.62 149.48 21.31 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-O 122.049 0.928 . . . . 0.0 113.02 176.222 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 77.2 m-85 -152.12 159.98 43.52 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 126.371 1.868 . . . . 0.0 109.746 -176.43 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 596' ' ' HIS . . . . . 0.426 ' HB2' ' HB2' ' A' ' 599' ' ' CYS . 28.8 m80 -76.76 140.2 40.69 Favored 'General case' 0 N--CA 1.473 0.694 0 O-C-N 120.915 -1.116 . . . . 0.0 108.369 167.82 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 53.1 p -63.76 -40.17 96.05 Favored 'General case' 0 N--CA 1.469 0.513 0 O-C-N 121.732 -0.605 . . . . 0.0 112.254 -177.74 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 7.2 p -69.39 -42.28 75.34 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 124.743 1.217 . . . . 0.0 113.157 174.844 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 599' ' ' CYS . . . . . 0.426 ' HB2' ' HB2' ' A' ' 596' ' ' HIS . 77.4 m -57.45 -54.95 41.05 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.304 1.042 . . . . 0.0 110.896 174.052 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 61.9 t80 -55.49 -49.01 73.66 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 124.09 0.956 . . . . 0.0 111.889 178.44 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 86.3 t60 -63.21 -40.32 97.15 Favored 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 113.114 0.783 . . . . 0.0 113.114 -178.795 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -71.45 -37.89 71.37 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 123.855 0.862 . . . . 0.0 112.657 176.83 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 91.6 m -86.02 -31.93 21.75 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 124.321 1.048 . . . . 0.0 113.549 -171.651 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 604' ' ' SER . . . . . . . . . . . . . 34.2 t -64.26 122.31 16.35 Favored 'General case' 0 N--CA 1.469 0.501 0 O-C-N 121.47 -0.769 . . . . 0.0 112.016 -177.616 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 605' ' ' GLN . . . . . . . . . . . . . 2.0 tm0? -78.94 144.07 35.18 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.541 1.136 . . . . 0.0 111.736 179.41 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 606' ' ' ASN . . . . . . . . . . . . . 80.6 m-20 -67.8 -28.64 67.77 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 124.126 0.97 . . . . 0.0 113.16 175.464 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 607' ' ' SER . . . . . . . . . . . . . 6.0 t 58.69 -165.32 0.18 Allowed 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 125.872 1.669 . . . . 0.0 113.468 -178.08 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 608' ' ' SER . . . . . . . . . . . . . 80.5 p . . . . . 0 C--O 1.253 1.241 0 C-N-CA 125.821 1.648 . . . . 0.0 114.541 179.554 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 18.0 mm . . . . . 0 N--CA 1.475 0.808 0 CA-C-O 120.74 0.305 . . . . 0.0 110.914 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 8.1 tmm_? -76.49 -23.83 53.79 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.919 1.288 . . . . 0.0 112.815 -177.243 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -71.45 -12.04 72.72 Favored Glycine 0 CA--C 1.541 1.689 0 C-N-CA 124.721 1.153 . . . . 0.0 115.579 175.941 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 71.8 mmtt -68.23 152.54 45.31 Favored 'General case' 0 N--CA 1.476 0.864 0 CA-C-N 119.108 1.454 . . . . 0.0 112.79 178.787 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 51.1 p90 -154.82 166.12 34.47 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 124.867 1.267 . . . . 0.0 112.629 172.796 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 1.6 m -135.35 140.2 45.32 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.885 0 C-N-CA 126.326 1.851 . . . . 0.0 110.294 175.767 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 78.8 t -69.07 130.9 34.22 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.232 0 O-C-N 121.297 -0.877 . . . . 0.0 111.278 -177.462 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 553' ' ' VAL . . . . . 0.458 HG22 ' CD2' ' A' ' 584' ' ' TRP . 11.2 t -79.26 122.44 84.16 Favored Pre-proline 0 CA--C 1.541 0.602 0 C-N-CA 124.183 0.993 . . . . 0.0 110.01 172.286 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -75.8 156.39 39.46 Favored 'Trans proline' 0 CA--C 1.537 0.663 0 C-N-CA 122.56 2.173 . . . . 0.0 112.251 176.484 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 15.7 pm0 -66.43 -17.25 64.68 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 124.295 1.038 . . . . 0.0 113.493 174.205 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 74.2 p -81.34 -9.28 59.78 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 125.891 1.677 . . . . 0.0 113.06 172.726 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 43.9 t -59.79 141.15 55.84 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 119.293 0.951 . . . . 0.0 113.225 179.451 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 88.3 mm-40 -75.11 97.13 3.38 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 124.115 0.966 . . . . 0.0 110.132 173.02 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 30.0 m-20 55.25 25.62 7.57 Favored 'General case' 0 CA--C 1.554 1.107 0 C-N-CA 126.288 1.835 . . . . 0.0 114.808 177.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 8.1 mtt 57.32 32.99 22.65 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 125.6 1.56 . . . . 0.0 114.707 179.391 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -137.8 149.4 46.34 Favored 'General case' 0 CA--C 1.538 0.489 0 N-CA-C 115.058 1.503 . . . . 0.0 115.058 -173.39 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 24.5 m-85 -149.25 165.68 31.19 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 127.34 2.256 . . . . 0.0 110.014 171.322 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 19.7 ttmm -117.95 133.9 55.47 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 123.928 0.891 . . . . 0.0 112.317 -179.092 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 14.4 t -73.59 111.73 13.26 Favored Pre-proline 0 CA--C 1.547 0.856 0 C-N-CA 127.045 2.138 . . . . 0.0 110.483 170.487 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 79.9 Cg_endo -70.64 -15.41 33.79 Favored 'Trans proline' 0 CA--C 1.542 0.913 0 C-N-CA 122.728 2.285 . . . . 0.0 114.132 175.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 93.0 mt -73.7 -56.12 10.33 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.823 0 C-N-CA 124.307 1.043 . . . . 0.0 110.924 -178.866 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 13.8 p -102.38 -1.68 30.36 Favored 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 124.752 1.221 . . . . 0.0 113.901 -179.816 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 568' ' ' LYS . . . . . . . . . . . . . 33.1 mmtp 62.65 41.67 9.08 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 127.072 2.149 . . . . 0.0 113.462 -178.173 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 75.0 mm-40 -122.76 145.62 48.25 Favored 'General case' 0 N--CA 1.482 1.175 0 N-CA-C 113.841 1.052 . . . . 0.0 113.841 -174.251 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 28.0 m -94.16 121.06 35.28 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.661 0.784 . . . . 0.0 111.463 -173.798 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 4.8 m -80.2 148.65 5.6 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.675 0 C-N-CA 124.62 1.168 . . . . 0.0 111.358 168.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 45.5 p -132.69 144.46 50.32 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 124.93 1.292 . . . . 0.0 111.193 174.843 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -67.31 152.17 52.59 Favored Glycine 0 CA--C 1.539 1.563 0 C-N-CA 124.419 1.009 . . . . 0.0 113.94 176.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 46.3 t -133.19 137.74 52.83 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.956 0 C-N-CA 125.937 1.695 . . . . 0.0 111.108 178.591 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 33.3 t80 -69.95 140.92 53.09 Favored 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 114.51 1.3 . . . . 0.0 114.51 -173.898 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 40.1 t0 -114.33 108.5 17.0 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 127.341 2.257 . . . . 0.0 110.469 170.858 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -66.23 -27.5 68.02 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 114.317 1.229 . . . . 0.0 114.317 -179.461 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -74.92 -50.76 15.73 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-N 118.994 0.815 . . . . 0.0 112.09 -176.79 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 25.3 t -77.52 -31.95 53.76 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 123.452 0.701 . . . . 0.0 111.704 174.255 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 81.92 29.53 38.07 Favored Glycine 0 CA--C 1.53 1.012 0 C-N-CA 124.011 0.815 . . . . 0.0 112.201 -173.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 80.0 mm-40 -129.61 -174.08 3.2 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 126.529 1.932 . . . . 0.0 110.156 -176.422 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 53.8 m95 -117.99 156.63 28.21 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.458 1.103 . . . . 0.0 110.986 178.815 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 17.7 m -137.62 140.36 41.57 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 C-N-CA 125.505 1.522 . . . . 0.0 112.816 -177.473 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 584' ' ' TRP . . . . . 0.458 ' CD2' HG22 ' A' ' 553' ' ' VAL . 1.1 m0 -90.95 105.6 17.94 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 126.575 1.95 . . . . 0.0 108.682 173.697 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 30.8 mmmt -72.27 142.52 48.91 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 125.144 1.378 . . . . 0.0 111.239 -177.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 57.9 t30 51.2 39.45 23.7 Favored 'General case' 0 CA--C 1.553 1.078 0 C-N-CA 125.633 1.573 . . . . 0.0 113.496 -177.247 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 89.7 m -124.01 149.63 45.8 Favored 'General case' 0 N--CA 1.482 1.129 0 O-C-N 120.629 -1.295 . . . . 0.0 112.966 -170.931 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 10.4 tt -141.51 137.27 32.4 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.636 0 C-N-CA 127.326 2.25 . . . . 0.0 110.638 178.909 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 77.5 tt0 -107.19 137.18 45.74 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 125.295 1.438 . . . . 0.0 109.664 169.715 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 7.6 p -151.71 123.29 1.06 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 C-N-CA 124.789 1.236 . . . . 0.0 110.847 179.084 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 35.3 m120 49.09 41.31 19.21 Favored 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 125.914 1.685 . . . . 0.0 114.11 174.433 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 85.97 1.41 86.85 Favored Glycine 0 CA--C 1.536 1.378 0 N-CA-C 116.071 1.189 . . . . 0.0 116.071 179.48 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -114.42 153.09 30.51 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 125.662 1.585 . . . . 0.0 111.984 177.469 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 42.0 m-85 -112.35 145.04 40.78 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 125.237 1.415 . . . . 0.0 111.937 177.8 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 99.1 m-85 -152.41 164.84 36.72 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 125.161 1.384 . . . . 0.0 111.541 -176.795 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 596' ' ' HIS . . . . . 0.426 ' HB2' ' HB2' ' A' ' 599' ' ' CYS . 21.4 m80 -78.15 144.51 36.35 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 166.501 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 19.5 t -64.16 -44.99 90.41 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 118.419 0.554 . . . . 0.0 111.365 178.29 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 22.8 p -64.09 -34.98 79.28 Favored 'General case' 0 N--CA 1.479 1.004 0 N-CA-C 114.016 1.117 . . . . 0.0 114.016 175.358 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 599' ' ' CYS . . . . . 0.426 ' HB2' ' HB2' ' A' ' 596' ' ' HIS . 87.9 m -71.53 -54.74 9.53 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 123.84 0.856 . . . . 0.0 111.22 176.226 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 70.7 t80 -61.04 -34.99 75.73 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 123.587 0.755 . . . . 0.0 112.606 -178.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 82.7 t60 -55.7 -31.88 62.83 Favored 'General case' 0 CA--C 1.543 0.688 0 O-C-N 121.167 -0.958 . . . . 0.0 113.554 176.394 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -73.27 -25.2 60.59 Favored 'General case' 0 CA--C 1.548 0.888 0 O-C-N 121.203 -0.935 . . . . 0.0 113.387 174.532 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 44.0 p . . . . . 0 N--CA 1.481 1.124 0 C-N-CA 125.384 1.474 . . . . 0.0 114.429 -175.439 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 12.0 mm . . . . . 0 N--CA 1.476 0.828 0 CA-C-O 120.467 0.175 . . . . 0.0 110.736 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 95.6 mtt-85 -77.84 -25.88 49.04 Favored 'General case' 0 N--CA 1.48 1.049 0 O-C-N 121.027 -1.046 . . . . 0.0 113.399 178.381 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -69.59 -9.01 61.08 Favored Glycine 0 CA--C 1.537 1.417 0 C-N-CA 125.537 1.541 . . . . 0.0 115.087 176.026 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -63.04 149.82 44.07 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-N 118.513 1.156 . . . . 0.0 111.714 170.744 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 45.6 p90 -156.44 166.61 32.93 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.205 1.002 . . . . 0.0 112.373 176.039 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 12.0 m -129.7 140.32 49.35 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 C-N-CA 126.299 1.84 . . . . 0.0 109.258 169.448 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 48.4 t -71.45 128.58 34.72 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.106 0 O-C-N 121.16 -0.963 . . . . 0.0 110.006 -177.225 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 553' ' ' VAL . . . . . 0.479 HG22 ' CD2' ' A' ' 584' ' ' TRP . 4.0 t -79.72 126.37 80.51 Favored Pre-proline 0 CA--C 1.538 0.498 0 C-N-CA 123.78 0.832 . . . . 0.0 109.001 171.169 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -66.82 145.15 73.9 Favored 'Trans proline' 0 CA--C 1.538 0.698 0 C-N-CA 122.734 2.289 . . . . 0.0 112.248 -177.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 17.1 pt-20 -63.14 -17.13 62.01 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 113.49 0.922 . . . . 0.0 113.49 175.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 10.7 m -66.08 -30.86 71.45 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 125.436 1.494 . . . . 0.0 112.002 171.729 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 28.7 t -81.01 130.84 35.2 Favored 'General case' 0 N--CA 1.472 0.643 0 O-C-N 121.632 -0.668 . . . . 0.0 111.684 174.062 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 2.6 pm0 -101.8 -25.8 13.69 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.692 1.597 . . . . 0.0 112.203 169.08 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 87.3 m-20 -77.41 -38.08 50.52 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 124.456 1.103 . . . . 0.0 112.924 179.781 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 8.7 mtt 51.46 36.01 15.69 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.694 1.597 . . . . 0.0 115.131 175.284 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -131.74 146.55 52.22 Favored 'General case' 0 CA--C 1.54 0.558 0 N-CA-C 114.057 1.132 . . . . 0.0 114.057 -173.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 2.8 t80 -153.98 179.66 8.7 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 125.749 1.62 . . . . 0.0 110.38 173.57 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 22.9 ttmm -135.05 138.16 43.62 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 124.434 1.094 . . . . 0.0 113.038 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 26.4 t -71.62 116.75 50.94 Favored Pre-proline 0 CA--C 1.539 0.544 0 C-N-CA 126.301 1.84 . . . . 0.0 110.198 170.271 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo -72.65 -17.68 26.04 Favored 'Trans proline' 0 CA--C 1.543 0.951 0 C-N-CA 122.859 2.373 . . . . 0.0 113.581 176.3 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 90.7 mt -73.02 -55.35 13.09 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 CA-C-N 119.803 1.183 . . . . 0.0 110.953 -178.547 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 14.9 p -103.35 2.76 34.44 Favored 'General case' 0 CA--C 1.553 1.062 0 C-N-CA 124.566 1.146 . . . . 0.0 113.494 -179.242 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 568' ' ' LYS . . . . . . . . . . . . 0.335 64.1 pttt 56.0 42.92 28.01 Favored 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 127.083 2.153 . . . . 0.0 113.608 -177.63 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 69.8 mm-40 -119.6 137.81 53.63 Favored 'General case' 0 N--CA 1.483 1.207 0 N-CA-C 114.803 1.409 . . . . 0.0 114.803 -174.666 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 49.9 m -74.37 140.55 44.86 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 124.679 1.192 . . . . 0.0 112.992 -178.214 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -114.84 145.51 20.5 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.617 0 C-N-CA 126.576 1.95 . . . . 0.0 110.86 168.948 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 44.6 p -133.31 141.53 48.01 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.601 1.16 . . . . 0.0 111.794 178.752 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -70.6 147.32 43.47 Favored Glycine 0 CA--C 1.534 1.236 0 C-N-CA 124.709 1.147 . . . . 0.0 113.615 -179.637 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 71.8 t -130.03 141.98 44.98 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 C-N-CA 125.318 1.447 . . . . 0.0 111.139 -179.737 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 62.0 t80 -65.41 131.33 46.16 Favored 'General case' 0 CA--C 1.544 0.742 0 CA-C-O 121.828 0.823 . . . . 0.0 112.725 -175.931 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 49.9 t0 -96.03 99.39 11.15 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 126.723 2.009 . . . . 0.0 111.391 174.061 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 69.0 mt-10 -66.34 -21.79 66.25 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 124.746 1.219 . . . . 0.0 113.958 179.776 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 36.7 tp10 -72.96 -34.66 66.64 Favored 'General case' 0 CA--C 1.542 0.645 0 O-C-N 120.499 -1.376 . . . . 0.0 113.103 -176.54 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 63.7 m -124.13 -13.13 7.33 Favored 'General case' 0 N--CA 1.474 0.749 0 N-CA-C 114.853 1.427 . . . . 0.0 114.853 -178.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 84.08 33.14 21.57 Favored Glycine 0 CA--C 1.531 1.055 0 C-N-CA 124.309 0.957 . . . . 0.0 113.209 176.209 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -121.83 -162.63 1.0 Allowed 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 125.14 1.376 . . . . 0.0 109.769 -178.488 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 62.8 m95 -129.18 155.08 46.09 Favored 'General case' 0 CA--C 1.533 0.302 0 O-C-N 121.116 -0.99 . . . . 0.0 111.465 175.431 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 16.2 m -139.37 134.03 39.54 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 C-N-CA 124.788 1.235 . . . . 0.0 112.933 -173.86 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 584' ' ' TRP . . . . . 0.479 ' CD2' HG22 ' A' ' 553' ' ' VAL . 1.0 OUTLIER -86.46 96.91 10.2 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 126.618 1.967 . . . . 0.0 108.331 169.748 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 67.3 mttm -74.34 149.75 40.44 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 124.674 1.19 . . . . 0.0 111.841 -179.838 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 64.79 0.62 1.2 Allowed 'General case' 0 CA--C 1.56 1.331 0 C-N-CA 126.805 2.042 . . . . 0.0 113.895 -172.269 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 54.0 m -94.91 149.05 21.66 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 125.622 1.569 . . . . 0.0 113.658 -171.186 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 14.4 tt -136.65 146.39 28.72 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.63 0 C-N-CA 127.834 2.454 . . . . 0.0 110.262 172.863 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 73.3 tt0 -108.3 126.87 53.33 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 124.632 1.173 . . . . 0.0 110.908 170.74 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 7.7 p -154.12 135.95 5.92 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 C-N-CA 124.951 1.3 . . . . 0.0 111.199 -177.441 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 71.9 m-20 52.54 38.28 25.27 Favored 'General case' 0 CA--C 1.552 1.057 0 C-N-CA 125.177 1.391 . . . . 0.0 113.666 -179.43 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 76.54 11.04 85.54 Favored Glycine 0 CA--C 1.535 1.305 0 C-N-CA 125.33 1.443 . . . . 0.0 115.62 178.438 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 56.8 mtmt -133.01 155.13 49.75 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 125.653 1.581 . . . . 0.0 111.907 -178.312 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 69.9 m-85 -92.48 147.2 23.09 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 124.271 1.028 . . . . 0.0 112.321 175.234 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 90.1 m-85 -152.21 171.12 18.43 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 126.554 1.942 . . . . 0.0 110.241 -174.432 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 596' ' ' HIS . . . . . . . . . . . . . 17.4 m80 -89.8 140.56 29.47 Favored 'General case' 0 N--CA 1.471 0.581 0 O-C-N 121.31 -0.869 . . . . 0.0 109.273 167.54 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 67.6 m -60.14 -41.72 93.31 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 123.391 0.676 . . . . 0.0 112.113 176.724 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 5.6 p -64.81 -42.73 94.77 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 124.977 1.311 . . . . 0.0 112.575 175.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 599' ' ' CYS . . . . . . . . . . . . . 90.8 m -65.57 -51.65 58.23 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 124.283 1.033 . . . . 0.0 111.108 177.147 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 83.7 t80 -57.84 -35.1 70.44 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 123.718 0.807 . . . . 0.0 112.608 178.064 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 1.7 m-70 -64.94 -21.63 66.86 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 114.352 1.241 . . . . 0.0 114.352 174.465 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 74.7 mt-10 -90.52 -34.15 15.66 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 119.369 0.986 . . . . 0.0 113.275 171.272 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 69.0 p . . . . . 0 N--CA 1.482 1.127 0 N-CA-C 114.542 1.312 . . . . 0.0 114.542 -175.057 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 30.1 mm . . . . . 0 CA--C 1.539 0.548 0 N-CA-C 110.519 -0.178 . . . . 0.0 110.519 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -74.31 -22.41 59.28 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 124.216 1.007 . . . . 0.0 113.219 176.416 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -72.61 -13.58 77.9 Favored Glycine 0 CA--C 1.537 1.416 0 C-N-CA 124.709 1.147 . . . . 0.0 115.085 174.941 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -69.08 143.05 54.33 Favored 'General case' 0 N--CA 1.476 0.826 0 CA-C-N 118.272 1.036 . . . . 0.0 111.909 176.882 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 54.8 p90 -151.74 164.5 36.86 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 124.545 1.138 . . . . 0.0 112.634 173.718 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 10.6 m -130.48 139.99 49.94 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 C-N-CA 126.491 1.917 . . . . 0.0 109.07 169.613 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 9.2 p -72.29 136.95 24.54 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.048 0 O-C-N 120.871 -1.143 . . . . 0.0 111.151 -175.781 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 11.9 t -84.06 120.06 74.24 Favored Pre-proline 0 N--CA 1.469 0.519 0 C-N-CA 124.122 0.969 . . . . 0.0 108.534 171.264 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 90.6 Cg_endo -73.56 156.76 49.44 Favored 'Trans proline' 0 CA--C 1.539 0.745 0 C-N-CA 122.724 2.283 . . . . 0.0 112.278 177.782 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -61.26 -24.17 66.19 Favored 'General case' 0 N--CA 1.482 1.168 0 O-C-N 121.473 -0.767 . . . . 0.0 112.656 175.069 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 67.8 p -74.08 -19.91 60.45 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 125.433 1.493 . . . . 0.0 114.136 176.181 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 4.1 m -75.54 95.39 3.31 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 119.073 0.851 . . . . 0.0 110.4 172.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 29.0 mt-30 -58.0 -43.17 86.46 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 125.457 1.503 . . . . 0.0 114.022 -169.846 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 63.6 m-20 -94.99 -12.04 27.4 Favored 'General case' 0 CA--C 1.545 0.786 0 N-CA-C 114.185 1.18 . . . . 0.0 114.185 -176.412 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 7.8 mtt 51.4 31.19 6.95 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 126.135 1.774 . . . . 0.0 113.787 -170.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -128.08 148.78 50.58 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.294 1.437 . . . . 0.0 112.256 -178.076 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -150.99 171.84 16.65 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 125.256 1.422 . . . . 0.0 109.761 176.186 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 563' ' ' LYS . . . . . . . . . . . . 0.292 0.0 OUTLIER -117.84 156.84 27.68 Favored 'General case' 0 N--CA 1.479 0.979 0 N-CA-C 114.715 1.376 . . . . 0.0 114.715 178.795 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 23.9 t -98.3 109.09 50.9 Favored Pre-proline 0 CA--C 1.539 0.519 0 C-N-CA 127.897 2.479 . . . . 0.0 109.999 169.803 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -62.33 -19.63 67.73 Favored 'Trans proline' 0 C--N 1.352 0.724 0 C-N-CA 123.148 2.565 . . . . 0.0 115.206 174.503 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 90.1 mt -73.78 -61.51 1.67 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.908 0 CA-C-N 119.455 1.025 . . . . 0.0 110.74 -178.756 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 15.7 p -96.19 -0.39 50.02 Favored 'General case' 0 CA--C 1.548 0.888 0 N-CA-C 114.126 1.158 . . . . 0.0 114.126 -177.335 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 568' ' ' LYS . . . . . . . . . . . . . 47.0 mmtm 58.59 46.14 15.14 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 125.904 1.682 . . . . 0.0 112.053 -176.684 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 53.2 mm-40 -117.8 161.12 20.24 Favored 'General case' 0 N--CA 1.484 1.249 0 N-CA-C 113.783 1.031 . . . . 0.0 113.783 -177.057 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 58.4 m -102.82 127.58 49.94 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 124.012 0.925 . . . . 0.0 112.442 -179.134 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 3.1 m -91.46 149.29 4.14 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 C-N-CA 124.651 1.18 . . . . 0.0 110.556 167.901 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 43.8 p -132.45 142.06 49.09 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 125.111 1.364 . . . . 0.0 110.585 174.888 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -67.25 152.49 52.73 Favored Glycine 0 CA--C 1.528 0.891 0 C-N-CA 124.092 0.853 . . . . 0.0 113.489 179.195 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 57.4 t -133.65 133.1 57.23 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.858 0 C-N-CA 125.253 1.421 . . . . 0.0 111.629 176.822 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 44.8 t80 -70.12 128.18 35.39 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 114.052 1.13 . . . . 0.0 114.052 -173.051 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 13.4 t0 -98.02 114.05 26.09 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 125.365 1.466 . . . . 0.0 109.02 168.409 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 9.7 mp0 -72.83 -27.24 61.83 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 114.242 1.201 . . . . 0.0 114.242 -173.95 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -83.26 -44.38 15.02 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 123.904 0.881 . . . . 0.0 112.058 179.869 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 59.8 m -71.85 -30.22 65.22 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.21 0.604 . . . . 0.0 112.249 171.884 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 77.4 26.37 61.56 Favored Glycine 0 CA--C 1.534 1.227 0 C-N-CA 124.797 1.189 . . . . 0.0 112.978 -177.905 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 55.0 mt-10 -142.43 150.94 41.26 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 125.598 1.559 . . . . 0.0 110.434 -171.49 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 43.3 m95 -84.67 151.78 24.22 Favored 'General case' 0 CA--C 1.543 0.677 0 O-C-N 121.204 -0.935 . . . . 0.0 111.23 179.629 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 17.3 m -134.39 139.35 48.15 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.31 0 C-N-CA 125.227 1.411 . . . . 0.0 112.792 -176.482 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 2.6 m0 -89.64 100.8 13.53 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 126.399 1.88 . . . . 0.0 107.855 171.27 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 53.2 mtmt -78.76 157.96 28.37 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 124.395 1.078 . . . . 0.0 112.024 179.809 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 9.1 t30 54.58 30.7 13.64 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 125.265 1.426 . . . . 0.0 113.047 -174.227 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 86.1 m -122.52 148.12 45.55 Favored 'General case' 0 N--CA 1.48 1.036 0 O-C-N 121.0 -1.063 . . . . 0.0 112.15 -169.774 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 15.6 tt -138.25 142.35 35.61 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 C-N-CA 127.313 2.245 . . . . 0.0 110.973 178.664 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 77.8 tt0 -102.96 127.27 50.25 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.457 1.103 . . . . 0.0 110.224 169.388 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 7.6 p -152.67 133.24 4.28 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 C-N-CA 125.113 1.365 . . . . 0.0 110.819 -178.971 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 74.9 m-20 53.96 41.71 31.93 Favored 'General case' 0 CA--C 1.551 0.986 0 C-N-CA 124.801 1.24 . . . . 0.0 113.104 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 73.7 11.26 80.61 Favored Glycine 0 CA--C 1.536 1.396 0 C-N-CA 124.813 1.197 . . . . 0.0 115.551 179.141 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 36.3 mtmm -134.96 156.13 49.55 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 126.341 1.857 . . . . 0.0 111.849 -173.418 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 75.9 m-85 -100.03 146.13 27.1 Favored 'General case' 0 N--CA 1.464 0.25 0 C-N-CA 124.364 1.066 . . . . 0.0 113.282 179.412 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 86.5 m-85 -151.76 165.9 33.0 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 126.592 1.957 . . . . 0.0 110.366 -173.913 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 596' ' ' HIS . . . . . 0.424 ' HB2' ' HB2' ' A' ' 599' ' ' CYS . 20.7 m80 -81.09 142.97 32.78 Favored 'General case' 0 N--CA 1.468 0.44 0 O-C-N 121.381 -0.824 . . . . 0.0 109.491 168.77 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 66.9 p -60.88 -44.79 96.59 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 123.919 0.888 . . . . 0.0 111.681 176.942 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 18.7 p -63.99 -44.7 91.89 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 125.023 1.329 . . . . 0.0 112.93 175.322 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 599' ' ' CYS . . . . . 0.424 ' HB2' ' HB2' ' A' ' 596' ' ' HIS . 97.5 m -60.97 -45.47 94.63 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.587 1.155 . . . . 0.0 111.792 178.605 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 84.2 t80 -72.95 -32.17 65.07 Favored 'General case' 0 CA--C 1.546 0.804 0 N-CA-C 113.382 0.882 . . . . 0.0 113.382 177.556 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 57.4 t-80 -75.16 -81.67 0.07 Allowed 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 114.706 1.373 . . . . 0.0 114.706 -174.178 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -95.93 -6.96 37.89 Favored 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 113.616 0.969 . . . . 0.0 113.616 -174.253 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 1.5 m . . . . . 0 N--CA 1.478 0.944 0 C-N-CA 124.585 1.154 . . . . 0.0 111.996 -177.975 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 11.2 mm . . . . . 0 CA--C 1.541 0.599 0 N-CA-C 110.297 -0.26 . . . . 0.0 110.297 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 79.7 ttt180 -65.94 -28.92 69.28 Favored 'General case' 0 N--CA 1.478 0.927 0 O-C-N 121.125 -0.984 . . . . 0.0 112.173 -179.202 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -71.96 -7.55 66.65 Favored Glycine 0 CA--C 1.542 1.734 0 C-N-CA 124.706 1.146 . . . . 0.0 115.428 175.061 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 41.8 mmtm -70.3 144.66 51.67 Favored 'General case' 0 N--CA 1.479 0.996 0 CA-C-N 119.771 1.786 . . . . 0.0 111.227 177.858 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 40.2 p90 -149.29 166.47 28.86 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 113.937 1.088 . . . . 0.0 113.937 178.198 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 4.8 m -136.74 138.84 45.8 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.841 0 C-N-CA 126.801 2.04 . . . . 0.0 109.73 174.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 44.0 t -70.29 133.98 30.88 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 O-C-N 121.084 -1.01 . . . . 0.0 110.998 -177.972 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 3.1 t -91.88 124.31 60.63 Favored Pre-proline 0 N--CA 1.471 0.591 0 C-N-CA 124.273 1.029 . . . . 0.0 111.639 178.198 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 62.1 Cg_endo -80.48 152.46 20.32 Favored 'Trans proline' 0 CA--C 1.538 0.714 0 C-N-CA 123.274 2.649 . . . . 0.0 111.638 169.893 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -66.77 -18.32 65.31 Favored 'General case' 0 CA--C 1.548 0.88 0 O-C-N 120.401 -1.437 . . . . 0.0 113.103 175.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -71.73 -22.65 61.6 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 124.877 1.271 . . . . 0.0 113.44 173.204 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 9.6 m -73.51 121.63 20.9 Favored 'General case' 0 N--CA 1.473 0.702 0 O-C-N 121.497 -0.752 . . . . 0.0 110.328 170.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 55.2 tp60 -53.41 116.09 2.26 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 125.077 1.351 . . . . 0.0 112.484 -168.514 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 53.31 20.95 2.1 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 126.559 1.944 . . . . 0.0 114.822 177.789 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 28.6 mtt 53.47 33.08 15.27 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 125.522 1.529 . . . . 0.0 113.443 -168.834 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -126.95 134.65 50.36 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 125.031 1.332 . . . . 0.0 112.544 -177.053 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 41.6 t80 -148.21 161.33 41.69 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 124.861 1.264 . . . . 0.0 110.041 174.948 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 3.5 ttmp? -112.67 131.26 55.73 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 123.827 0.851 . . . . 0.0 113.001 -171.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 22.6 t -68.11 111.77 8.8 Favored Pre-proline 0 CA--C 1.541 0.633 0 C-N-CA 126.064 1.745 . . . . 0.0 109.479 168.644 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -69.83 -17.34 37.32 Favored 'Trans proline' 0 CA--C 1.54 0.815 0 C-N-CA 122.515 2.143 . . . . 0.0 113.349 177.691 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 86.8 mt -70.28 -51.54 37.63 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.672 0 C-N-CA 124.593 1.157 . . . . 0.0 110.898 -177.706 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 14.6 p -110.75 -0.86 16.89 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 124.729 1.212 . . . . 0.0 114.071 -178.877 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 568' ' ' LYS . . . . . . . . . . . . . 34.1 mmtp 60.64 45.86 9.88 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 126.604 1.962 . . . . 0.0 113.352 -177.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 74.7 mt-10 -120.79 138.67 53.91 Favored 'General case' 0 N--CA 1.481 1.078 0 N-CA-C 113.746 1.017 . . . . 0.0 113.746 -175.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 97.1 m -83.77 121.48 27.36 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.256 0.622 . . . . 0.0 112.181 -179.234 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 1.7 m -88.11 143.65 10.82 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 C-N-CA 125.22 1.408 . . . . 0.0 110.364 168.172 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 69.1 p -124.62 142.77 51.13 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 124.971 1.309 . . . . 0.0 111.629 -179.187 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -74.97 145.55 33.8 Favored Glycine 0 CA--C 1.53 0.988 0 C-N-CA 124.302 0.953 . . . . 0.0 113.372 179.065 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 61.6 t -135.32 141.6 42.11 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.875 0 C-N-CA 125.599 1.56 . . . . 0.0 111.554 -177.336 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 62.1 t80 -70.52 127.39 32.55 Favored 'General case' 0 CA--C 1.542 0.64 0 O-C-N 121.277 -0.889 . . . . 0.0 112.976 -176.697 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 65.1 t0 -94.12 104.21 16.24 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 127.072 2.149 . . . . 0.0 109.892 170.015 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -66.89 -26.97 67.14 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.072 1.349 . . . . 0.0 114.45 -177.624 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 31.8 tp10 -78.66 -44.31 24.04 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 123.609 0.763 . . . . 0.0 111.713 -178.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 22.8 t -81.57 -35.32 30.37 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 124.903 1.281 . . . . 0.0 112.276 177.219 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 84.17 32.81 22.18 Favored Glycine 0 CA--C 1.53 1.031 0 C-N-CA 124.513 1.054 . . . . 0.0 113.468 -172.736 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 81.8 mm-40 -130.16 178.54 6.48 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.479 1.512 . . . . 0.0 110.705 -175.537 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 68.6 m95 -111.25 145.4 38.82 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 121.015 -1.053 . . . . 0.0 110.251 171.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 13.8 m -137.72 138.04 44.68 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.892 0 C-N-CA 124.985 1.314 . . . . 0.0 113.227 -172.057 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 0.8 OUTLIER -87.26 100.95 13.07 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 126.327 1.851 . . . . 0.0 107.228 169.952 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 56.7 mtmt -73.56 157.03 37.46 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 124.184 0.993 . . . . 0.0 111.253 177.093 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 55.2 33.4 20.48 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 125.307 1.443 . . . . 0.0 112.392 -176.407 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 55.2 m -130.36 147.78 52.1 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 124.71 1.204 . . . . 0.0 112.239 -169.432 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 14.7 tt -136.41 144.16 33.61 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.718 0 C-N-CA 126.978 2.111 . . . . 0.0 111.096 178.543 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -105.89 135.79 46.7 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 125.243 1.417 . . . . 0.0 110.157 168.722 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 7.5 p -147.66 123.51 2.64 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.619 0 C-N-CA 124.289 1.036 . . . . 0.0 111.006 173.88 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 69.9 m-20 51.08 36.58 15.78 Favored 'General case' 0 CA--C 1.551 1.003 0 C-N-CA 125.472 1.509 . . . . 0.0 114.245 175.402 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 89.15 -9.19 77.82 Favored Glycine 0 CA--C 1.536 1.405 0 C-N-CA 125.32 1.438 . . . . 0.0 115.633 -179.221 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 63.4 mttp -95.87 153.77 17.58 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 125.578 1.551 . . . . 0.0 111.78 176.329 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 69.1 m-85 -113.38 142.75 45.5 Favored 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 125.0 1.32 . . . . 0.0 112.259 174.485 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 16.3 m-85 -149.18 159.01 44.63 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 126.307 1.843 . . . . 0.0 110.6 -173.569 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 596' ' ' HIS . . . . . . . . . . . . . 11.8 m80 -71.31 139.13 49.81 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 106.539 -1.652 . . . . 0.0 106.539 165.555 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 72.8 p -59.3 -43.0 92.65 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 122.995 0.518 . . . . 0.0 111.935 178.603 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 14.1 p -71.59 -33.41 69.01 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 125.362 1.465 . . . . 0.0 113.693 178.144 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 599' ' ' CYS . . . . . . . . . . . . . 99.3 m -66.68 -52.46 44.57 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.657 0.783 . . . . 0.0 111.021 172.495 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 66.1 t80 -57.53 -40.67 79.32 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 123.183 0.593 . . . . 0.0 111.955 176.73 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 69.8 t60 -56.36 -46.84 79.82 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.837 1.255 . . . . 0.0 113.872 175.384 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -77.76 -23.75 49.15 Favored 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 114.044 1.127 . . . . 0.0 114.044 174.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 68.4 m . . . . . 0 N--CA 1.48 1.047 0 C-N-CA 124.939 1.296 . . . . 0.0 112.714 179.227 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 18.5 mm . . . . . 0 N--CA 1.476 0.831 0 CA-C-O 120.612 0.244 . . . . 0.0 111.454 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 45.0 ttt180 -61.34 -21.66 64.21 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.518 1.127 . . . . 0.0 112.879 179.442 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -71.79 -11.67 73.75 Favored Glycine 0 CA--C 1.539 1.569 0 C-N-CA 124.643 1.116 . . . . 0.0 115.251 176.03 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -69.76 146.32 51.55 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-N 119.201 1.501 . . . . 0.0 112.18 173.417 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 47.6 p90 -156.5 166.52 33.18 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 124.955 1.302 . . . . 0.0 111.772 171.59 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 2.5 m -128.93 133.5 66.0 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 C-N-CA 124.618 1.167 . . . . 0.0 109.745 170.479 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 53.3 t -68.23 132.41 32.78 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 O-C-N 121.26 -0.9 . . . . 0.0 110.113 -179.796 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 22.4 t -78.97 119.08 75.94 Favored Pre-proline 0 N--CA 1.472 0.651 0 CA-C-O 118.483 -0.77 . . . . 0.0 110.588 -179.239 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 65.3 Cg_endo -78.82 156.24 27.24 Favored 'Trans proline' 0 CA--C 1.537 0.643 0 C-N-CA 123.126 2.551 . . . . 0.0 112.15 176.84 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -67.47 -17.81 64.83 Favored 'General case' 0 N--CA 1.474 0.738 0 O-C-N 121.486 -0.759 . . . . 0.0 112.884 176.885 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 66.8 p -74.06 -22.99 59.31 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 125.02 1.328 . . . . 0.0 113.493 173.913 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 24.7 m -80.2 112.09 17.18 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 123.997 0.919 . . . . 0.0 111.683 175.258 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -62.08 136.22 57.85 Favored 'General case' 0 CA--C 1.546 0.824 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 -173.667 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 33.8 m-20 53.92 15.32 0.83 Allowed 'General case' 0 CA--C 1.553 1.073 0 C-N-CA 126.733 2.013 . . . . 0.0 115.418 176.918 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 18.9 mtt 51.35 31.93 7.78 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 125.672 1.589 . . . . 0.0 114.659 -171.494 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -123.95 142.67 50.95 Favored 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 113.851 1.056 . . . . 0.0 113.851 -174.526 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 6.5 t80 -153.91 -179.97 8.35 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 125.919 1.688 . . . . 0.0 109.963 173.378 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 18.1 ttmm -130.56 152.91 49.42 Favored 'General case' 0 N--CA 1.48 1.032 0 O-C-N 120.628 -1.295 . . . . 0.0 113.385 -175.273 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 19.2 t -95.9 107.0 31.5 Favored Pre-proline 0 CA--C 1.543 0.71 0 C-N-CA 127.865 2.466 . . . . 0.0 110.307 170.865 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_exo -62.38 -20.45 70.37 Favored 'Trans proline' 0 CA--C 1.546 1.086 0 C-N-CA 122.268 1.979 . . . . 0.0 115.736 174.71 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 88.7 mt -69.38 -52.26 34.51 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 C-N-CA 124.266 1.026 . . . . 0.0 111.35 -177.205 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 14.9 p -108.62 -0.71 20.06 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 124.328 1.051 . . . . 0.0 113.717 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 568' ' ' LYS . . . . . . . . . . . . . 95.1 mttt 59.82 44.43 13.88 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 126.966 2.106 . . . . 0.0 113.151 -177.571 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 64.8 mt-10 -112.0 138.93 47.97 Favored 'General case' 0 N--CA 1.479 0.995 0 N-CA-C 113.488 0.922 . . . . 0.0 113.488 -177.697 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 57.7 m -85.71 121.24 28.1 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 123.216 0.606 . . . . 0.0 111.037 177.778 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 3.8 m -88.4 144.15 9.76 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 C-N-CA 125.442 1.497 . . . . 0.0 110.502 170.414 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 74.6 p -128.94 144.81 51.29 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.976 1.311 . . . . 0.0 110.799 174.274 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -72.03 141.06 30.95 Favored Glycine 0 CA--C 1.525 0.677 0 C-N-CA 124.152 0.882 . . . . 0.0 112.547 -178.138 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 33.3 m -132.63 139.72 49.18 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 C-N-CA 124.497 1.119 . . . . 0.0 112.001 -178.545 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 79.2 t80 -75.32 113.69 12.99 Favored 'General case' 0 CA--C 1.54 0.589 0 O-C-N 121.4 -0.813 . . . . 0.0 111.284 179.581 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -82.3 118.21 22.97 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.371 1.068 . . . . 0.0 110.447 170.67 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 11.6 mp0 -73.87 -28.11 61.41 Favored 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 114.017 1.117 . . . . 0.0 114.017 -173.335 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 32.8 tp10 -81.52 -41.92 20.97 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.228 1.011 . . . . 0.0 111.914 -179.41 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 36.0 t -74.62 -35.88 62.93 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 125.016 1.326 . . . . 0.0 112.015 173.072 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 80.91 33.1 30.79 Favored Glycine 0 CA--C 1.534 1.246 0 C-N-CA 124.491 1.043 . . . . 0.0 113.053 -177.042 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 69.9 mm-40 -144.93 149.95 36.15 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 125.138 1.375 . . . . 0.0 111.716 -171.518 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 84.5 m95 -76.89 134.5 38.96 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 122.723 0.409 . . . . 0.0 110.555 170.032 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 8.1 m -139.41 145.05 27.71 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 C-N-CA 124.658 1.183 . . . . 0.0 113.007 -168.765 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 2.8 m0 -93.81 97.6 10.52 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 106.715 -1.587 . . . . 0.0 106.715 167.623 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 61.6 mttm -74.32 145.07 44.21 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 124.447 1.099 . . . . 0.0 111.959 -175.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 62.9 t30 52.16 37.12 20.91 Favored 'General case' 0 CA--C 1.551 0.994 0 C-N-CA 126.33 1.852 . . . . 0.0 113.201 -170.588 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 88.4 m -119.18 147.13 44.55 Favored 'General case' 0 N--CA 1.481 1.108 0 O-C-N 120.67 -1.269 . . . . 0.0 112.252 -176.148 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 13.2 tt -136.66 145.65 29.94 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.64 0 C-N-CA 127.888 2.475 . . . . 0.0 110.719 -178.9 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 73.5 tt0 -105.7 125.68 51.27 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.569 1.148 . . . . 0.0 110.564 169.793 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 8.3 p -158.93 145.84 7.5 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 C-N-CA 124.997 1.319 . . . . 0.0 110.655 179.876 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 53.9 t30 53.01 38.73 28.04 Favored 'General case' 0 CA--C 1.554 1.111 0 C-N-CA 124.431 1.092 . . . . 0.0 112.55 -177.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 65.95 14.89 61.81 Favored Glycine 0 CA--C 1.534 1.257 0 C-N-CA 125.51 1.529 . . . . 0.0 115.971 -179.844 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 35.8 mtmm -134.83 159.95 39.76 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 126.349 1.86 . . . . 0.0 110.938 -177.278 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 70.4 m-85 -91.03 149.7 21.73 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-O 121.979 0.895 . . . . 0.0 112.08 169.866 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 9.8 m-85 -145.9 165.31 29.31 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 127.283 2.233 . . . . 0.0 109.387 177.576 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 596' ' ' HIS . . . . . . . . . . . . . 26.7 m80 -77.94 141.88 38.73 Favored 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 108.161 -1.052 . . . . 0.0 108.161 166.102 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 8.4 t -65.94 -41.73 90.94 Favored 'General case' 0 N--CA 1.466 0.353 0 O-C-N 121.805 -0.559 . . . . 0.0 112.018 -177.186 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 22.3 p -64.72 -42.64 95.09 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 123.608 0.763 . . . . 0.0 112.683 173.666 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 599' ' ' CYS . . . . . . . . . . . . . 64.2 m -56.14 -58.27 8.66 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.589 1.155 . . . . 0.0 110.824 174.617 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 76.5 t80 -58.69 -46.77 86.51 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.414 0.686 . . . . 0.0 112.456 179.793 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 33.9 t-80 -58.73 -47.21 85.39 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 124.102 0.961 . . . . 0.0 113.129 -176.662 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 35.5 tp10 -77.29 -30.5 54.23 Favored 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 112.72 0.637 . . . . 0.0 112.72 -179.902 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 98.6 m . . . . . 0 N--CA 1.479 1.004 0 C-N-CA 123.761 0.825 . . . . 0.0 112.981 -176.787 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 33.9 mm . . . . . 0 CA--C 1.542 0.658 0 N-CA-C 110.847 -0.057 . . . . 0.0 110.847 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 19.0 tpp180 -68.14 -34.62 76.7 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 124.333 1.053 . . . . 0.0 111.767 175.896 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -72.61 -6.14 65.73 Favored Glycine 0 CA--C 1.537 1.424 0 C-N-CA 125.76 1.648 . . . . 0.0 115.645 177.176 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 73.4 mmtt -76.67 125.84 29.94 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-N 119.576 1.688 . . . . 0.0 110.289 171.897 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 39.5 p90 -149.29 162.89 39.15 Favored 'General case' 0 C--O 1.237 0.404 0 N-CA-C 113.277 0.843 . . . . 0.0 113.277 176.619 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -135.68 138.13 48.37 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.485 0 C-N-CA 126.274 1.83 . . . . 0.0 110.422 179.044 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 76.2 t -70.54 134.92 29.18 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.939 0 C-N-CA 123.821 0.849 . . . . 0.0 110.812 -175.61 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 72.7 t -64.96 121.79 75.87 Favored Pre-proline 0 CA--C 1.544 0.719 0 C-N-CA 124.22 1.008 . . . . 0.0 108.957 173.491 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -87.0 -9.11 6.42 Favored 'Trans proline' 0 CA--C 1.536 0.586 0 C-N-CA 124.583 3.522 . . . . 0.0 114.54 -169.144 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 63.48 -24.63 0.07 Allowed 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 127.826 2.45 . . . . 0.0 114.627 -168.408 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 80.6 p -64.53 -18.91 65.26 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 124.989 1.315 . . . . 0.0 111.995 169.333 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 33.5 p -65.56 -8.24 18.86 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 126.692 1.997 . . . . 0.0 114.184 168.493 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? 68.26 -36.78 0.32 Allowed 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 128.408 2.683 . . . . 0.0 116.644 169.751 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 28.9 t0 -125.54 14.24 8.17 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 125.167 1.387 . . . . 0.0 113.45 178.319 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 80.2 mtp 56.63 22.48 6.77 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 126.276 1.83 . . . . 0.0 114.368 -179.49 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -133.3 152.51 51.93 Favored 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 125.818 1.647 . . . . 0.0 112.012 -170.089 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 10.5 m-85 -148.82 156.43 42.33 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 125.527 1.531 . . . . 0.0 111.823 171.495 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 47.2 tttp -85.81 153.01 22.57 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 124.385 1.074 . . . . 0.0 113.248 -178.634 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 13.7 t -104.89 101.78 31.49 Favored Pre-proline 0 CA--C 1.547 0.831 0 C-N-CA 126.559 1.943 . . . . 0.0 109.128 165.017 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -61.33 -21.16 71.02 Favored 'Trans proline' 0 CA--C 1.541 0.825 0 C-N-CA 122.726 2.284 . . . . 0.0 115.496 176.76 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 89.3 mt -72.87 -58.07 5.71 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 C-N-CA 124.495 1.118 . . . . 0.0 111.658 -177.691 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 14.4 p -98.12 2.62 48.77 Favored 'General case' 0 CA--C 1.552 1.055 0 C-N-CA 123.977 0.911 . . . . 0.0 113.346 179.406 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 568' ' ' LYS . . . . . . . . . . . . 0.326 20.1 ptpt 54.85 42.85 30.81 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 127.566 2.346 . . . . 0.0 113.434 -177.401 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 71.2 mm-40 -109.84 -177.27 3.22 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.624 0.77 . . . . 0.0 112.196 179.26 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 64.4 m -132.34 120.99 22.82 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 124.556 1.142 . . . . 0.0 110.977 178.218 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -81.74 149.77 4.73 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 C-N-CA 124.456 1.102 . . . . 0.0 110.258 168.056 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 3.4 t -149.0 155.62 41.06 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.969 0.907 . . . . 0.0 112.388 171.436 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -58.47 148.28 38.09 Favored Glycine 0 CA--C 1.534 1.251 0 C-N-CA 126.18 1.848 . . . . 0.0 116.661 -168.648 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 60.8 t -136.2 132.6 49.76 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 C-N-CA 125.691 1.596 . . . . 0.0 111.567 173.413 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 57.7 t80 -73.67 127.69 33.46 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 113.327 0.862 . . . . 0.0 113.327 -175.113 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 22.7 t0 -99.37 122.76 42.95 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 125.705 1.602 . . . . 0.0 110.45 169.237 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 64.7 mt-10 -73.55 -24.27 60.1 Favored 'General case' 0 CA--C 1.544 0.74 0 N-CA-C 113.793 1.035 . . . . 0.0 113.793 177.94 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -77.16 -52.48 9.2 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 119.401 1.001 . . . . 0.0 112.115 -176.234 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 89.9 p -74.42 -24.98 59.17 Favored 'General case' 0 N--CA 1.479 0.995 0 O-C-N 121.548 -0.72 . . . . 0.0 112.048 169.296 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 78.31 28.81 55.06 Favored Glycine 0 CA--C 1.536 1.403 0 C-N-CA 124.501 1.048 . . . . 0.0 113.15 -179.62 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -143.2 159.03 43.07 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.718 1.607 . . . . 0.0 112.645 -172.304 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 82.3 m95 -78.73 137.39 37.75 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.805 0.842 . . . . 0.0 111.677 176.946 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 19.2 m -130.0 151.28 35.62 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.762 0 C-N-CA 126.261 1.824 . . . . 0.0 112.912 -178.032 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 5.7 m0 -97.09 104.35 16.36 Favored 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 126.452 1.901 . . . . 0.0 110.553 169.321 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -70.87 148.39 47.85 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 124.221 1.009 . . . . 0.0 111.987 179.091 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 48.3 t30 50.45 45.48 26.34 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 124.855 1.262 . . . . 0.0 112.518 -179.785 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 94.2 m -130.93 145.84 52.15 Favored 'General case' 0 N--CA 1.48 1.052 0 N-CA-C 113.95 1.092 . . . . 0.0 113.95 -170.113 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 8.3 tt -143.33 151.72 16.89 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.62 0 C-N-CA 128.078 2.551 . . . . 0.0 110.477 -177.792 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 73.1 tt0 -119.03 126.8 52.55 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.338 1.455 . . . . 0.0 109.792 169.696 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 2.8 t -142.01 131.98 24.22 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 C-N-CA 126.78 2.032 . . . . 0.0 109.868 -175.795 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 16.5 m120 52.44 36.87 21.22 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 124.91 1.284 . . . . 0.0 113.931 178.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 78.67 8.93 87.47 Favored Glycine 0 CA--C 1.54 1.625 0 C-N-CA 124.796 1.189 . . . . 0.0 115.518 -179.752 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 53.0 mtmt -126.56 148.57 49.73 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 126.209 1.804 . . . . 0.0 111.431 -178.646 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 20.9 m-85 -89.58 149.12 22.99 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.167 0.987 . . . . 0.0 111.979 177.004 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 94.2 m-85 -151.34 162.85 40.18 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 125.783 1.633 . . . . 0.0 111.345 -179.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 596' ' ' HIS . . . . . 0.407 ' HB2' ' HB2' ' A' ' 599' ' ' CYS . 24.6 m80 -78.44 140.58 38.64 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 167.901 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 19.7 m -64.86 -39.52 93.68 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 118.36 0.527 . . . . 0.0 111.673 179.223 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 22.6 p -62.4 -46.08 90.24 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 123.721 0.808 . . . . 0.0 112.943 172.781 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 599' ' ' CYS . . . . . 0.407 ' HB2' ' HB2' ' A' ' 596' ' ' HIS . 94.0 m -60.04 -54.41 46.35 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 124.226 1.01 . . . . 0.0 111.312 177.883 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 89.7 t80 -62.32 -41.71 98.77 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.293 0.637 . . . . 0.0 112.126 -179.18 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 12.9 t-160 -61.29 -44.36 97.34 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.087 0.955 . . . . 0.0 112.388 176.348 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 25.8 tt0 -71.94 -34.39 68.98 Favored 'General case' 0 CA--C 1.545 0.788 0 N-CA-C 113.291 0.849 . . . . 0.0 113.291 178.612 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 92.1 m . . . . . 0 N--CA 1.478 0.926 0 N-CA-C 113.871 1.063 . . . . 0.0 113.871 -172.26 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 29.6 mm . . . . . 0 N--CA 1.479 1.014 0 CA-C-O 120.525 0.203 . . . . 0.0 111.333 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 19.8 ptp180 -75.43 -17.8 60.07 Favored 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 113.575 0.954 . . . . 0.0 113.575 -179.676 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -80.88 -9.57 86.13 Favored Glycine 0 CA--C 1.531 1.094 0 C-N-CA 124.77 1.176 . . . . 0.0 114.562 -179.38 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 69.3 mmtt -73.58 143.68 46.31 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 118.522 1.161 . . . . 0.0 112.221 179.581 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 40.6 p90 -159.69 167.21 28.9 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 125.292 1.437 . . . . 0.0 111.886 173.848 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 2.6 m -133.65 141.9 43.0 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.725 0 C-N-CA 125.928 1.691 . . . . 0.0 110.252 171.22 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 7.4 p -76.47 137.22 23.04 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.059 0 O-C-N 121.156 -0.965 . . . . 0.0 112.642 -170.241 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 72.5 t -75.64 125.68 88.23 Favored Pre-proline 0 N--CA 1.472 0.631 0 C-N-CA 124.475 1.11 . . . . 0.0 109.696 171.554 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_endo -78.34 142.67 19.05 Favored 'Trans proline' 0 CA--C 1.539 0.772 0 C-N-CA 122.994 2.463 . . . . 0.0 111.154 173.538 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -63.18 -17.38 62.33 Favored 'General case' 0 N--CA 1.48 1.037 0 O-C-N 121.016 -1.053 . . . . 0.0 113.063 172.36 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 11.3 m -64.93 -27.04 68.58 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 125.782 1.633 . . . . 0.0 112.71 171.481 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 29.2 t -70.6 125.86 27.99 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-N 119.12 0.873 . . . . 0.0 111.907 179.484 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 45.8 tt0 -74.99 -27.14 60.03 Favored 'General case' 0 CA--C 1.55 0.948 0 N-CA-C 112.953 0.723 . . . . 0.0 112.953 176.402 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 20.3 t0 -118.98 -11.37 9.69 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 114.328 1.233 . . . . 0.0 114.328 -172.363 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 79.8 mtp 56.98 34.85 25.58 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 125.976 1.71 . . . . 0.0 113.391 177.566 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -139.63 153.63 47.37 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 115.586 1.699 . . . . 0.0 115.586 -169.579 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 19.9 m-85 -148.18 174.3 12.12 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 128.449 2.699 . . . . 0.0 108.75 169.734 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 7.3 ttpm? -132.15 142.18 49.38 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 124.287 1.035 . . . . 0.0 113.114 -175.059 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 22.3 t -83.11 114.99 56.58 Favored Pre-proline 0 CA--C 1.546 0.819 0 C-N-CA 127.948 2.499 . . . . 0.0 111.03 172.778 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -63.5 -26.38 70.14 Favored 'Trans proline' 0 CA--C 1.538 0.705 0 C-N-CA 123.144 2.563 . . . . 0.0 114.985 173.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 89.8 mt -70.35 -55.44 14.51 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.885 0 C-N-CA 124.359 1.063 . . . . 0.0 111.552 -173.581 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 14.3 p -103.54 1.13 31.85 Favored 'General case' 0 CA--C 1.553 1.086 0 C-N-CA 124.79 1.236 . . . . 0.0 113.587 179.725 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 568' ' ' LYS . . . . . . . . . . . . . 29.6 mtpp 60.65 41.45 15.21 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 126.447 1.899 . . . . 0.0 112.448 -179.832 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 77.1 mt-10 -114.23 133.89 55.31 Favored 'General case' 0 N--CA 1.486 1.331 0 N-CA-C 114.208 1.188 . . . . 0.0 114.208 -174.033 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 89.3 m -83.58 118.43 23.8 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 124.051 0.94 . . . . 0.0 111.289 177.573 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 3.5 m -81.95 149.09 4.91 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 124.566 1.146 . . . . 0.0 110.715 168.805 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 82.3 p -133.08 156.36 47.54 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 125.504 1.522 . . . . 0.0 111.273 177.008 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -65.58 140.82 41.39 Favored Glycine 0 CA--C 1.532 1.109 0 N-CA-C 115.043 0.777 . . . . 0.0 115.043 -178.763 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 85.6 t -134.49 131.47 54.39 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 C-N-CA 125.236 1.414 . . . . 0.0 110.492 178.489 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 74.6 t80 -73.89 123.9 25.13 Favored 'General case' 0 CA--C 1.543 0.673 0 N-CA-C 113.573 0.953 . . . . 0.0 113.573 -173.731 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 54.0 t0 -92.64 114.93 27.62 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.214 1.406 . . . . 0.0 109.559 169.233 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -71.32 -27.07 63.13 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 114.062 1.134 . . . . 0.0 114.062 -175.648 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 50.1 mm-40 -88.18 -39.26 14.64 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 124.282 1.033 . . . . 0.0 112.034 -179.591 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 32.4 t -70.84 -35.01 72.24 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 122.964 0.506 . . . . 0.0 112.058 169.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 81.35 25.57 54.19 Favored Glycine 0 CA--C 1.534 1.222 0 C-N-CA 125.058 1.313 . . . . 0.0 112.921 -176.482 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 78.8 mm-40 -141.57 152.65 44.25 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.89 1.276 . . . . 0.0 111.876 -170.461 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 84.2 m95 -77.06 138.68 39.7 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 123.862 0.865 . . . . 0.0 110.757 171.584 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 23.4 m -135.24 148.72 28.63 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 C-N-CA 125.415 1.486 . . . . 0.0 113.31 -175.63 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 4.1 m0 -87.63 99.62 12.2 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 126.534 1.934 . . . . 0.0 109.169 169.694 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 32.6 mmtp -68.72 148.44 50.37 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 124.093 0.957 . . . . 0.0 111.881 -178.245 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 64.2 t30 53.63 33.43 16.47 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 125.763 1.625 . . . . 0.0 113.144 179.221 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 90.1 m -116.87 142.83 46.43 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 124.05 0.94 . . . . 0.0 112.645 -171.736 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 11.1 tt -134.94 144.91 33.29 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 C-N-CA 127.71 2.404 . . . . 0.0 110.116 -179.638 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 73.6 tt0 -112.18 136.99 50.89 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 124.683 1.193 . . . . 0.0 110.713 171.272 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 12.7 p -148.56 136.12 13.97 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 C-N-CA 124.421 1.088 . . . . 0.0 110.925 172.268 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 66.0 t30 51.22 37.21 17.87 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 125.038 1.335 . . . . 0.0 113.537 177.761 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 78.1 8.3 87.44 Favored Glycine 0 CA--C 1.537 1.424 0 C-N-CA 124.829 1.204 . . . . 0.0 116.086 -179.279 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -122.94 149.61 44.04 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 125.92 1.688 . . . . 0.0 111.879 -178.147 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 72.6 m-85 -98.69 147.12 25.17 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.633 1.173 . . . . 0.0 113.176 -179.665 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 98.6 m-85 -150.85 168.89 23.1 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 126.551 1.94 . . . . 0.0 110.706 179.664 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 596' ' ' HIS . . . . . . . . . . . . . 22.8 m80 -86.17 144.17 27.62 Favored 'General case' 0 N--CA 1.471 0.605 0 O-C-N 121.288 -0.882 . . . . 0.0 110.08 168.057 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 15.6 m -65.35 -43.54 90.55 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 123.42 0.688 . . . . 0.0 111.969 179.888 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 22.2 p -64.64 -37.69 88.44 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 124.013 0.925 . . . . 0.0 112.966 174.29 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 599' ' ' CYS . . . . . . . . . . . . . 89.6 m -65.86 -59.76 3.54 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.135 0.974 . . . . 0.0 110.965 176.211 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 75.8 t80 -59.13 -38.39 79.52 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.169 0.988 . . . . 0.0 113.481 -175.245 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 76.6 t60 -56.69 -58.3 8.69 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 114.712 1.375 . . . . 0.0 114.712 -173.198 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 15.2 tt0 -98.14 -10.87 23.5 Favored 'General case' 0 CA--C 1.545 0.767 0 N-CA-C 113.637 0.977 . . . . 0.0 113.637 -174.387 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 98.6 m . . . . . 0 N--CA 1.485 1.276 0 O-C-N 121.157 -0.964 . . . . 0.0 112.242 179.42 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 16.7 mm . . . . . 0 CA--C 1.539 0.554 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 7.3 tmm_? -66.37 -36.35 82.65 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 124.111 0.964 . . . . 0.0 111.39 178.919 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -67.15 -6.4 39.02 Favored Glycine 0 CA--C 1.535 1.307 0 C-N-CA 125.704 1.621 . . . . 0.0 116.561 175.801 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt -70.95 134.37 47.14 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-N 119.754 1.777 . . . . 0.0 110.991 171.494 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 41.6 p90 -148.49 166.74 27.29 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 114.443 1.275 . . . . 0.0 114.443 179.697 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -136.91 138.99 45.4 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 C-N-CA 126.776 2.03 . . . . 0.0 109.241 173.722 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 83.8 t -70.48 132.02 33.67 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.994 0 O-C-N 121.043 -1.036 . . . . 0.0 110.908 -174.701 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 87.3 t -71.72 124.87 91.55 Favored Pre-proline 0 CA--C 1.541 0.629 0 C-N-CA 125.331 1.453 . . . . 0.0 109.963 175.268 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 95.5 Cg_endo -78.87 152.21 24.92 Favored 'Trans proline' 0 C--N 1.349 0.567 0 C-N-CA 123.036 2.49 . . . . 0.0 112.19 177.293 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 56.1 mt-10 -62.54 -21.67 65.74 Favored 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 113.215 0.82 . . . . 0.0 113.215 174.001 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 67.8 p -78.61 -11.85 59.99 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 125.89 1.676 . . . . 0.0 113.882 176.104 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 88.5 p -63.7 144.26 57.17 Favored 'General case' 0 N--CA 1.48 1.032 0 CA-C-N 119.242 0.928 . . . . 0.0 112.756 178.062 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 64.5 mt-30 -83.12 118.62 23.7 Favored 'General case' 0 N--CA 1.467 0.404 0 O-C-N 121.449 -0.782 . . . . 0.0 109.287 169.657 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 38.0 m-20 52.15 24.31 2.7 Favored 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 126.415 1.886 . . . . 0.0 115.197 177.47 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 8.9 mtt 54.75 36.21 25.81 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.97 1.308 . . . . 0.0 113.65 -176.453 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -125.03 147.09 49.13 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 114.368 1.247 . . . . 0.0 114.368 -171.491 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 6.5 t80 -155.48 166.4 33.66 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 125.611 1.564 . . . . 0.0 111.084 172.193 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 39.5 ttmt -107.61 148.7 28.97 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 124.907 1.283 . . . . 0.0 114.352 -171.129 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 33.9 t -95.15 110.45 50.28 Favored Pre-proline 0 CA--C 1.543 0.709 0 C-N-CA 128.384 2.674 . . . . 0.0 110.033 167.905 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -64.66 -21.7 65.05 Favored 'Trans proline' 0 CA--C 1.538 0.701 0 C-N-CA 123.037 2.491 . . . . 0.0 115.425 177.649 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 85.0 mt -70.95 -55.46 13.99 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.928 0 C-N-CA 124.025 0.93 . . . . 0.0 110.873 -177.436 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 14.7 p -103.38 0.1 30.83 Favored 'General case' 0 CA--C 1.552 1.052 0 N-CA-C 113.909 1.078 . . . . 0.0 113.909 -178.251 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 568' ' ' LYS . . . . . . . . . . . . 0.332 25.0 pttm 55.32 46.1 24.18 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 127.775 2.43 . . . . 0.0 113.419 -175.481 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 69.6 mm-40 -121.16 150.15 41.72 Favored 'General case' 0 N--CA 1.483 1.176 0 N-CA-C 113.715 1.006 . . . . 0.0 113.715 -175.583 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 89.1 m -93.46 120.79 34.16 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 124.108 0.963 . . . . 0.0 112.303 -176.111 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 2.6 m -79.14 147.16 6.94 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.671 0 C-N-CA 124.215 1.006 . . . . 0.0 110.084 167.326 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 68.6 p -127.53 148.05 50.33 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 124.52 1.128 . . . . 0.0 111.386 175.547 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -70.75 147.39 43.34 Favored Glycine 0 CA--C 1.534 1.26 0 C-N-CA 123.887 0.756 . . . . 0.0 114.001 -178.55 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 85.9 t -133.62 136.37 54.42 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 C-N-CA 125.362 1.465 . . . . 0.0 111.185 177.235 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 63.8 t80 -72.99 118.87 16.47 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 123.478 0.711 . . . . 0.0 112.78 -176.622 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 63.4 t0 -82.68 110.52 17.81 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 168.436 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 57.9 mt-10 -68.12 -25.86 65.51 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 124.692 1.197 . . . . 0.0 113.946 -175.445 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 38.0 tp10 -80.51 -48.44 12.78 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 123.255 0.622 . . . . 0.0 112.229 -176.371 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 99.1 p -78.82 -28.72 44.48 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 123.52 0.728 . . . . 0.0 112.473 173.416 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 82.15 31.13 32.34 Favored Glycine 0 CA--C 1.538 1.474 0 C-N-CA 124.853 1.216 . . . . 0.0 112.606 -177.049 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 56.2 mt-10 -135.34 145.59 47.57 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 118.636 1.218 . . . . 0.0 111.311 -173.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 69.9 m95 -77.54 141.02 39.82 Favored 'General case' 0 N--CA 1.466 0.342 0 O-C-N 121.273 -0.892 . . . . 0.0 111.523 177.235 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 17.3 m -135.91 142.59 38.6 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 C-N-CA 125.853 1.661 . . . . 0.0 112.757 -172.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 2.0 m0 -88.97 95.36 10.29 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 125.175 1.39 . . . . 0.0 108.019 170.168 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -69.5 160.94 30.51 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 124.291 1.036 . . . . 0.0 111.396 175.007 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 54.61 32.05 16.31 Favored 'General case' 0 CA--C 1.553 1.074 0 C-N-CA 125.04 1.336 . . . . 0.0 112.607 -177.92 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 73.0 m -125.15 146.73 49.36 Favored 'General case' 0 N--CA 1.479 0.984 0 O-C-N 120.978 -1.077 . . . . 0.0 113.564 -169.492 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 18.1 tt -143.19 149.29 18.55 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 C-N-CA 127.085 2.154 . . . . 0.0 110.85 177.924 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 72.6 tt0 -107.89 122.27 46.45 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 124.482 1.113 . . . . 0.0 110.002 168.744 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 2.0 t -144.16 142.11 24.29 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.866 0 C-N-CA 126.332 1.853 . . . . 0.0 109.682 -174.559 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 23.8 t-20 52.27 26.64 4.14 Favored 'General case' 0 CA--C 1.554 1.128 0 C-N-CA 125.526 1.531 . . . . 0.0 114.189 177.537 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 88.42 1.79 80.6 Favored Glycine 0 CA--C 1.54 1.646 0 C-N-CA 125.721 1.629 . . . . 0.0 116.455 -177.786 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 2.7 mptt -128.43 161.18 30.08 Favored 'General case' 0 N--CA 1.479 1.01 0 CA-C-N 119.42 1.61 . . . . 0.0 113.285 -177.823 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 3.6 m-85 -81.78 148.9 28.65 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 115.541 -0.754 . . . . 0.0 111.59 171.746 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 64.2 m-85 -152.87 161.79 42.11 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 126.334 1.853 . . . . 0.0 110.854 -178.106 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 596' ' ' HIS . . . . . 0.413 ' HB2' ' HB2' ' A' ' 599' ' ' CYS . 21.1 m80 -76.97 136.14 38.73 Favored 'General case' 0 N--CA 1.473 0.698 0 N-CA-C 108.259 -1.015 . . . . 0.0 108.259 167.222 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 47.8 p -59.39 -37.45 77.99 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 123.532 0.733 . . . . 0.0 112.375 178.114 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 5.7 p -70.31 -50.51 38.48 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.723 1.209 . . . . 0.0 112.637 175.171 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 599' ' ' CYS . . . . . 0.413 ' HB2' ' HB2' ' A' ' 596' ' ' HIS . 91.4 m -51.51 -52.26 48.34 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.278 1.031 . . . . 0.0 111.423 175.007 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 53.6 t80 -58.51 -52.21 66.61 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 123.483 0.713 . . . . 0.0 111.734 176.605 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 51.6 t-80 -61.81 -38.53 88.48 Favored 'General case' 0 N--CA 1.475 0.824 0 N-CA-C 113.372 0.878 . . . . 0.0 113.372 -176.489 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -71.07 -18.9 62.53 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 113.736 1.014 . . . . 0.0 113.736 175.567 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 88.7 m . . . . . 0 N--CA 1.476 0.83 0 C-N-CA 124.624 1.17 . . . . 0.0 112.132 -177.733 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 31.1 mm . . . . . 0 N--CA 1.473 0.687 0 N-CA-C 112.712 0.634 . . . . 0.0 112.712 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 9.4 ptp180 -70.08 -10.86 60.11 Favored 'General case' 0 N--CA 1.478 0.971 0 N-CA-C 115.756 1.761 . . . . 0.0 115.756 -170.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -77.42 -14.56 82.37 Favored Glycine 0 CA--C 1.539 1.542 0 C-N-CA 123.905 0.765 . . . . 0.0 114.838 178.04 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -71.59 147.05 47.99 Favored 'General case' 0 N--CA 1.477 0.911 0 CA-C-N 118.831 1.316 . . . . 0.0 113.472 -177.118 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 51.6 p90 -154.84 162.48 41.09 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 125.603 1.561 . . . . 0.0 111.698 169.554 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -134.74 137.57 50.79 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 C-N-CA 125.899 1.68 . . . . 0.0 110.295 177.709 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 40.7 t -68.29 132.02 33.06 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 C-N-CA 123.671 0.788 . . . . 0.0 109.951 -179.122 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 21.2 t -73.66 123.69 89.61 Favored Pre-proline 0 N--CA 1.474 0.745 0 C-N-CA 124.144 0.978 . . . . 0.0 109.131 171.075 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_endo -70.59 146.32 54.76 Favored 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 122.5 2.133 . . . . 0.0 111.699 178.045 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -62.98 -18.77 63.64 Favored 'General case' 0 N--CA 1.474 0.75 0 O-C-N 121.367 -0.833 . . . . 0.0 113.157 174.184 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 18.7 m -58.53 -32.76 69.16 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 124.943 1.297 . . . . 0.0 111.726 169.296 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 19.7 t -81.73 101.57 10.19 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.623 0.769 . . . . 0.0 111.372 172.079 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 93.0 mt-30 -71.86 -30.66 65.67 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 123.289 0.636 . . . . 0.0 112.242 175.071 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 76.5 m-20 -91.12 -19.7 22.83 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.152 0.981 . . . . 0.0 113.456 -177.348 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 6.2 mtt 55.76 33.08 20.72 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 125.815 1.646 . . . . 0.0 114.95 178.779 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -133.25 136.61 45.66 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.027 0.931 . . . . 0.0 113.24 -175.317 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -143.61 161.1 39.38 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 126.329 1.852 . . . . 0.0 110.753 175.53 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 23.7 tptt -94.75 157.85 15.77 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 124.442 1.097 . . . . 0.0 113.626 -173.957 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 15.2 t -109.98 96.45 25.08 Favored Pre-proline 0 CA--C 1.547 0.838 0 C-N-CA 126.755 2.022 . . . . 0.0 107.566 165.659 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -60.06 -17.61 46.1 Favored 'Trans proline' 0 CA--C 1.548 1.183 0 C-N-CA 122.586 2.191 . . . . 0.0 115.342 177.325 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 73.0 mt -72.58 -58.25 5.41 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.892 0 C-N-CA 124.81 1.244 . . . . 0.0 111.076 -179.942 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 13.7 p -101.93 1.64 37.04 Favored 'General case' 0 CA--C 1.553 1.074 0 N-CA-C 113.964 1.098 . . . . 0.0 113.964 -179.24 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 568' ' ' LYS . . . . . . . . . . . . . 53.6 mtmt 62.37 36.38 14.45 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 128.125 2.57 . . . . 0.0 113.322 -179.033 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 51.2 mm-40 -100.71 173.03 6.72 Favored 'General case' 0 N--CA 1.481 1.124 0 O-C-N 121.731 -0.606 . . . . 0.0 112.539 -177.796 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 59.2 m -118.26 120.97 39.25 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 124.542 1.137 . . . . 0.0 110.71 172.81 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 1.5 m -83.28 121.51 36.26 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.726 0 C-N-CA 124.837 1.255 . . . . 0.0 109.667 169.169 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 47.6 p -106.17 141.72 37.06 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 124.822 1.249 . . . . 0.0 111.263 175.002 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -65.91 148.27 50.88 Favored Glycine 0 CA--C 1.528 0.873 0 C-N-CA 124.099 0.857 . . . . 0.0 113.438 179.241 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 65.0 t -131.21 129.01 62.49 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 C-N-CA 125.743 1.617 . . . . 0.0 111.25 179.909 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 35.1 t80 -74.74 124.38 26.66 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 113.004 0.742 . . . . 0.0 113.004 -175.144 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 64.0 t0 -90.61 106.37 18.46 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.92 1.288 . . . . 0.0 109.156 168.609 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 57.7 mt-10 -66.54 -26.38 67.11 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.051 0.94 . . . . 0.0 113.427 -178.324 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -81.82 -44.72 16.55 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 124.38 1.072 . . . . 0.0 111.798 -178.642 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 53.9 m -77.37 -26.88 52.33 Favored 'General case' 0 N--CA 1.476 0.859 0 N-CA-C 112.946 0.721 . . . . 0.0 112.946 174.318 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 76.99 29.05 57.66 Favored Glycine 0 CA--C 1.539 1.561 0 C-N-CA 125.052 1.311 . . . . 0.0 113.52 -176.445 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 77.4 mm-40 -139.24 150.91 46.05 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 125.839 1.656 . . . . 0.0 111.164 -173.256 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 67.7 m95 -84.73 146.07 27.6 Favored 'General case' 0 N--CA 1.468 0.427 0 O-C-N 121.396 -0.815 . . . . 0.0 110.852 173.468 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 27.9 m -133.49 151.75 33.98 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.977 0 C-N-CA 125.838 1.655 . . . . 0.0 113.678 -178.382 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 3.3 m0 -105.22 107.89 19.12 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 127.241 2.217 . . . . 0.0 107.128 171.606 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -86.24 149.62 24.95 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 125.013 1.325 . . . . 0.0 112.594 -174.791 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 65.0 t30 50.8 32.57 7.31 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 126.106 1.762 . . . . 0.0 113.008 -169.576 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 98.0 m -113.81 146.57 39.76 Favored 'General case' 0 N--CA 1.476 0.833 0 O-C-N 120.92 -1.113 . . . . 0.0 111.993 -172.685 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 9.3 tt -127.55 137.52 57.44 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 C-N-CA 126.779 2.031 . . . . 0.0 110.783 175.101 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -94.98 130.86 41.46 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 125.302 1.441 . . . . 0.0 110.185 169.484 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 12.7 p -150.84 132.42 5.15 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 C-N-CA 124.813 1.245 . . . . 0.0 111.254 174.472 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 77.3 m-20 52.04 40.06 27.65 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 124.935 1.294 . . . . 0.0 114.484 174.504 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 77.4 10.24 86.36 Favored Glycine 0 CA--C 1.541 1.674 0 C-N-CA 125.39 1.472 . . . . 0.0 115.257 -178.866 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 48.6 mttp -133.2 171.65 13.73 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 126.885 2.074 . . . . 0.0 111.03 -170.837 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 84.6 m-85 -121.98 153.09 39.0 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 124.373 1.069 . . . . 0.0 113.673 -176.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 23.8 m-85 -151.87 164.82 36.29 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 126.986 2.115 . . . . 0.0 109.941 175.921 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 596' ' ' HIS . . . . . . . . . . . . . 25.5 m80 -77.76 138.67 39.14 Favored 'General case' 0 N--CA 1.468 0.46 0 N-CA-C 107.407 -1.331 . . . . 0.0 107.407 165.906 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 5.5 t -64.36 -39.07 93.14 Favored 'General case' 0 CA--C 1.539 0.539 0 O-C-N 121.597 -0.69 . . . . 0.0 111.952 -177.454 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 18.3 p -66.3 -37.28 85.05 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 124.735 1.214 . . . . 0.0 113.61 173.354 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 599' ' ' CYS . . . . . . . . . . . . . 72.3 m -63.88 -54.83 28.67 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 123.797 0.839 . . . . 0.0 110.644 173.337 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 75.9 t80 -57.97 -37.51 74.32 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 125.046 1.339 . . . . 0.0 112.665 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 11.8 t-160 -60.59 -35.52 76.3 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.231 1.012 . . . . 0.0 113.19 176.254 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -79.67 -33.35 41.28 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 113.65 0.982 . . . . 0.0 113.65 176.328 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 69.8 p . . . . . 0 N--CA 1.48 1.032 0 N-CA-C 114.645 1.35 . . . . 0.0 114.645 -174.922 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 14.6 mm . . . . . 0 N--CA 1.476 0.873 0 CA-C-O 120.632 0.253 . . . . 0.0 111.232 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 39.3 mmt180 -58.19 -25.5 61.64 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 124.24 1.016 . . . . 0.0 112.799 171.856 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -79.88 -7.62 88.36 Favored Glycine 0 CA--C 1.536 1.394 0 C-N-CA 125.966 1.746 . . . . 0.0 115.013 -179.983 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 8.9 mmpt? -66.7 147.02 53.83 Favored 'General case' 0 N--CA 1.482 1.131 0 CA-C-N 119.811 1.805 . . . . 0.0 111.091 171.793 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 52.5 p90 -151.51 162.46 40.92 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.549 0.739 . . . . 0.0 112.787 171.193 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 1.6 m -130.44 134.69 61.94 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.926 0 C-N-CA 125.853 1.661 . . . . 0.0 109.74 173.075 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 10.0 p -67.8 138.01 23.5 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 O-C-N 121.616 -0.678 . . . . 0.0 111.731 -175.75 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 57.6 t -87.94 112.09 46.87 Favored Pre-proline 0 CA--C 1.544 0.744 0 C-N-CA 125.459 1.504 . . . . 0.0 108.941 170.19 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 67.5 Cg_endo -76.66 156.33 35.67 Favored 'Trans proline' 0 C--N 1.348 0.525 0 C-N-CA 122.62 2.213 . . . . 0.0 111.664 176.045 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 46.7 tt0 -58.02 -33.49 69.01 Favored 'General case' 0 CA--C 1.54 0.59 0 O-C-N 121.331 -0.856 . . . . 0.0 112.282 174.125 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 15.2 m -59.04 -25.98 64.18 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 125.463 1.505 . . . . 0.0 113.719 175.299 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 10.0 t -69.12 -23.61 64.0 Favored 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 113.092 0.775 . . . . 0.0 113.092 177.229 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 30.5 mt-30 59.35 -62.37 0.05 OUTLIER 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 129.211 3.005 . . . . 0.0 115.915 176.251 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 65.9 m-20 -82.21 -14.14 56.03 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 125.733 1.613 . . . . 0.0 113.374 -175.804 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 11.1 mtt 56.96 25.68 10.91 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 126.398 1.879 . . . . 0.0 114.976 179.582 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -131.42 144.75 51.42 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.265 1.026 . . . . 0.0 113.265 -171.748 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 4.5 t80 -153.84 -178.45 7.06 Favored 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 125.899 1.68 . . . . 0.0 109.668 173.131 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 5.2 tmmm? -137.05 134.17 36.25 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 125.027 1.331 . . . . 0.0 112.635 -178.695 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 30.9 t -69.55 117.17 50.4 Favored Pre-proline 0 CA--C 1.543 0.707 0 C-N-CA 126.681 1.993 . . . . 0.0 111.007 174.086 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_exo -65.11 -26.59 57.56 Favored 'Trans proline' 0 CA--C 1.542 0.885 0 C-N-CA 123.047 2.498 . . . . 0.0 114.646 175.739 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 80.6 mt -71.52 -57.46 7.44 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 C-N-CA 124.622 1.169 . . . . 0.0 111.418 -173.325 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 16.9 p -98.54 -1.86 40.1 Favored 'General case' 0 CA--C 1.549 0.932 0 N-CA-C 113.61 0.967 . . . . 0.0 113.61 179.276 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 568' ' ' LYS . . . . . . . . . . . . . 95.7 mttt 60.35 46.7 9.73 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 126.621 1.968 . . . . 0.0 112.778 -177.781 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 73.2 mm-40 -125.85 139.08 53.78 Favored 'General case' 0 N--CA 1.483 1.176 0 N-CA-C 115.481 1.66 . . . . 0.0 115.481 -174.24 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 24.4 m -69.66 138.51 53.07 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.734 1.214 . . . . 0.0 113.127 -179.109 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -112.73 140.07 34.5 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 C-N-CA 126.639 1.976 . . . . 0.0 109.904 167.841 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 44.4 p -130.42 144.03 51.14 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 125.377 1.471 . . . . 0.0 110.961 178.452 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -65.95 144.27 46.3 Favored Glycine 0 CA--C 1.53 1.006 0 C-N-CA 123.773 0.701 . . . . 0.0 114.093 -179.118 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 19.2 m -128.92 149.22 33.43 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 C-N-CA 125.68 1.592 . . . . 0.0 111.742 174.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 62.8 t80 -74.25 140.42 44.99 Favored 'General case' 0 CA--C 1.542 0.663 0 O-C-N 121.311 -0.868 . . . . 0.0 113.08 -175.94 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 21.1 t0 -115.81 118.53 33.28 Favored 'General case' 0 C--O 1.236 0.342 0 C-N-CA 126.776 2.031 . . . . 0.0 110.82 171.186 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 23.6 mp0 -74.27 -25.97 59.92 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 124.183 0.993 . . . . 0.0 113.383 -177.389 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 37.2 tp10 -74.48 -49.13 23.44 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 124.421 1.088 . . . . 0.0 112.195 -179.459 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 20.5 m -77.18 -31.71 55.6 Favored 'General case' 0 N--CA 1.476 0.833 0 O-C-N 121.739 -0.601 . . . . 0.0 111.924 172.637 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 76.38 30.48 56.7 Favored Glycine 0 CA--C 1.535 1.309 0 C-N-CA 123.506 0.574 . . . . 0.0 111.878 -170.11 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 79.9 mm-40 -130.95 175.92 8.67 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 126.253 1.821 . . . . 0.0 111.085 -174.166 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 62.4 m95 -100.15 149.77 23.19 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 123.969 0.908 . . . . 0.0 111.026 172.306 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 13.0 m -140.84 147.05 23.14 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 C-N-CA 125.94 1.696 . . . . 0.0 112.871 -172.311 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 4.1 m0 -97.64 106.64 18.99 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 125.905 1.682 . . . . 0.0 107.891 169.057 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 42.8 mtmt -81.96 153.22 26.37 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 124.133 0.973 . . . . 0.0 112.282 -179.456 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 54.25 33.65 18.66 Favored 'General case' 0 CA--C 1.554 1.101 0 C-N-CA 125.646 1.578 . . . . 0.0 111.601 -174.825 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 65.5 m -130.03 150.86 51.12 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 125.307 1.443 . . . . 0.0 112.293 -169.407 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 9.9 tt -140.24 146.32 24.82 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.653 0 C-N-CA 128.508 2.723 . . . . 0.0 110.108 -179.667 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 67.3 tt0 -113.77 132.87 55.69 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 125.35 1.46 . . . . 0.0 110.689 170.272 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 9.4 p -157.19 143.71 9.71 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 C-N-CA 124.479 1.112 . . . . 0.0 111.411 176.378 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 9.4 t-20 52.78 32.9 13.0 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 125.285 1.434 . . . . 0.0 114.421 178.223 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 76.05 9.76 85.33 Favored Glycine 0 CA--C 1.538 1.489 0 C-N-CA 124.698 1.142 . . . . 0.0 115.563 -177.511 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 99.6 mttt -122.13 152.45 39.88 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 126.013 1.725 . . . . 0.0 111.493 -179.983 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 79.0 m-85 -98.65 150.62 21.57 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 124.084 0.954 . . . . 0.0 112.751 170.304 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 93.4 m-85 -151.44 161.51 42.56 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 125.959 1.704 . . . . 0.0 110.1 -179.681 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 596' ' ' HIS . . . . . 0.437 ' HB2' ' HB2' ' A' ' 599' ' ' CYS . 28.6 m80 -75.71 141.89 42.58 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 167.027 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 50.3 p -61.26 -42.71 99.1 Favored 'General case' 0 N--CA 1.47 0.525 0 C-N-CA 123.592 0.757 . . . . 0.0 112.214 -179.321 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 2.7 p -68.35 -42.0 79.85 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 124.42 1.088 . . . . 0.0 112.791 175.457 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 599' ' ' CYS . . . . . 0.437 ' HB2' ' HB2' ' A' ' 596' ' ' HIS . 69.4 m -58.68 -59.2 5.79 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.192 0.997 . . . . 0.0 110.894 175.068 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 79.2 t80 -57.76 -43.25 85.35 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.375 1.07 . . . . 0.0 112.648 -177.912 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 82.5 t60 -58.13 -39.49 78.85 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 179.855 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 37.9 tp10 -90.45 -25.26 20.43 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 114.241 1.2 . . . . 0.0 114.241 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 28.3 m . . . . . 0 N--CA 1.482 1.164 0 N-CA-C 115.766 1.765 . . . . 0.0 115.766 -166.924 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 22.7 mm . . . . . 0 N--CA 1.476 0.829 0 CA-C-O 120.509 0.195 . . . . 0.0 111.45 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 30.7 mmm-85 -64.59 -29.93 70.95 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.739 1.216 . . . . 0.0 112.693 178.564 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -82.54 -7.29 87.7 Favored Glycine 0 CA--C 1.535 1.282 0 C-N-CA 125.056 1.312 . . . . 0.0 115.133 179.9 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -69.99 145.85 51.51 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 118.904 1.352 . . . . 0.0 111.829 176.806 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 38.6 p90 -153.39 166.92 31.15 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 125.032 1.333 . . . . 0.0 112.773 175.296 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 2.4 m -131.1 138.72 52.75 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.5 0 C-N-CA 125.733 1.613 . . . . 0.0 110.136 169.774 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 9.9 p -69.36 136.41 26.32 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 O-C-N 121.319 -0.863 . . . . 0.0 111.623 -176.993 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 51.1 t -76.31 123.89 88.0 Favored Pre-proline 0 CA--C 1.543 0.706 0 C-N-CA 124.805 1.242 . . . . 0.0 109.586 177.352 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -74.9 150.2 38.33 Favored 'Trans proline' 0 CA--C 1.543 0.939 0 C-N-CA 122.993 2.462 . . . . 0.0 111.028 175.998 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 50.3 mt-10 -65.09 -19.29 65.92 Favored 'General case' 0 CA--C 1.549 0.926 0 N-CA-C 113.479 0.918 . . . . 0.0 113.479 177.723 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 68.2 p -68.71 -24.92 64.54 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 124.216 1.006 . . . . 0.0 113.153 170.334 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 17.5 t -79.36 76.55 5.93 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-O 122.371 1.081 . . . . 0.0 110.299 169.791 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 62.6 tt0 -60.33 -34.45 73.84 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.356 1.062 . . . . 0.0 112.956 -174.496 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 69.4 m-20 -87.51 -6.59 58.3 Favored 'General case' 0 CA--C 1.551 0.981 0 C-N-CA 124.954 1.302 . . . . 0.0 113.74 175.114 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 9.0 mtt 52.24 38.44 24.66 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 126.785 2.034 . . . . 0.0 114.188 -178.116 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -128.26 143.43 51.03 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 114.244 1.201 . . . . 0.0 114.244 -173.168 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -143.36 176.54 9.08 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 126.487 1.915 . . . . 0.0 109.322 172.826 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 563' ' ' LYS . . . . . . . . . . . . 0.255 0.0 OUTLIER -141.76 148.16 38.52 Favored 'General case' 0 N--CA 1.477 0.888 0 N-CA-C 114.767 1.395 . . . . 0.0 114.767 175.891 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 12.0 t -79.32 116.85 63.49 Favored Pre-proline 0 CA--C 1.542 0.636 0 C-N-CA 126.765 2.026 . . . . 0.0 111.006 173.451 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_endo -72.51 -18.15 26.12 Favored 'Trans proline' 0 CA--C 1.545 1.073 0 C-N-CA 122.719 2.279 . . . . 0.0 113.612 174.782 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 90.7 mt -71.49 -55.22 14.47 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.9 0 C-N-CA 124.514 1.125 . . . . 0.0 110.747 -178.442 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 13.9 p -103.61 2.52 33.42 Favored 'General case' 0 CA--C 1.552 1.028 0 N-CA-C 114.137 1.162 . . . . 0.0 114.137 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 568' ' ' LYS . . . . . . . . . . . . 0.308 11.9 ptmm? 54.52 46.61 24.52 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 127.04 2.136 . . . . 0.0 113.82 -177.045 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 69.2 mm-40 -124.81 143.33 50.87 Favored 'General case' 0 N--CA 1.482 1.143 0 N-CA-C 114.835 1.42 . . . . 0.0 114.835 -176.108 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 73.9 m -78.06 145.66 35.72 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 124.241 1.017 . . . . 0.0 112.749 -178.589 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -119.61 131.7 71.43 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.892 0 C-N-CA 127.014 2.126 . . . . 0.0 109.752 168.305 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 38.9 p -111.86 147.02 36.67 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 125.064 1.345 . . . . 0.0 111.753 178.277 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -71.02 147.57 43.16 Favored Glycine 0 CA--C 1.532 1.101 0 C-N-CA 124.933 1.254 . . . . 0.0 113.743 178.621 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 60.9 t -139.47 132.49 36.93 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 C-N-CA 124.56 1.144 . . . . 0.0 111.083 -176.465 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 68.5 t80 -70.12 112.1 6.24 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 118.706 0.684 . . . . 0.0 111.522 179.478 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 23.2 t0 -81.8 112.02 18.57 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 123.331 0.653 . . . . 0.0 109.559 169.39 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 53.6 mt-10 -69.43 -19.31 63.79 Favored 'General case' 0 CA--C 1.546 0.812 0 N-CA-C 113.913 1.079 . . . . 0.0 113.913 178.836 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 33.2 tp10 -77.38 -51.41 10.86 Favored 'General case' 0 CA--C 1.543 0.71 0 O-C-N 121.366 -0.834 . . . . 0.0 112.811 178.898 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 32.2 t -76.06 -33.42 59.58 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 124.309 1.044 . . . . 0.0 112.686 172.318 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 86.09 31.18 20.84 Favored Glycine 0 CA--C 1.531 1.064 0 C-N-CA 125.038 1.304 . . . . 0.0 113.63 -176.761 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 74.1 mm-40 -142.31 151.66 42.19 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 125.504 1.522 . . . . 0.0 111.825 -172.459 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 82.5 m95 -75.84 134.4 40.36 Favored 'General case' 0 N--CA 1.468 0.437 0 O-C-N 121.653 -0.654 . . . . 0.0 111.7 172.521 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 17.0 m -135.05 143.0 38.5 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.559 0 C-N-CA 125.414 1.486 . . . . 0.0 113.327 -171.844 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 3.7 m0 -91.03 100.95 13.72 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 126.287 1.835 . . . . 0.0 107.857 169.288 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -73.98 153.85 39.56 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 124.169 0.988 . . . . 0.0 111.66 -179.68 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 54.63 36.75 26.76 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 125.03 1.332 . . . . 0.0 112.047 179.409 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 85.0 m -129.83 148.19 51.68 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 125.173 1.389 . . . . 0.0 112.113 -170.328 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 588' ' ' ILE . . . . . 0.406 HG23 ' HB2' ' A' ' 595' ' ' PHE . 15.4 tt -145.84 146.3 19.46 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 C-N-CA 126.912 2.085 . . . . 0.0 111.503 -178.388 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 8.9 tm-20 -107.54 145.6 32.94 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.852 1.261 . . . . 0.0 111.172 166.343 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 1.2 t -159.32 144.58 6.56 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 C-N-CA 126.196 1.798 . . . . 0.0 109.765 171.589 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 10.6 t-20 54.99 29.87 13.09 Favored 'General case' 0 CA--C 1.554 1.133 0 N-CA-C 114.17 1.174 . . . . 0.0 114.17 175.036 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 76.73 14.06 82.91 Favored Glycine 0 CA--C 1.535 1.284 0 C-N-CA 124.618 1.104 . . . . 0.0 115.066 -176.45 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 51.1 mttp -131.31 146.83 52.46 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 126.088 1.755 . . . . 0.0 110.873 -171.337 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 57.4 m-85 -102.35 147.85 26.2 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 123.857 0.863 . . . . 0.0 112.838 -178.329 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 595' ' ' PHE . . . . . 0.406 ' HB2' HG23 ' A' ' 588' ' ' ILE . 89.8 m-85 -153.19 164.46 38.02 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.914 1.686 . . . . 0.0 111.574 -169.879 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 596' ' ' HIS . . . . . 0.43 ' HB2' ' HB2' ' A' ' 599' ' ' CYS . 17.6 m80 -77.83 140.72 39.4 Favored 'General case' 0 N--CA 1.473 0.694 0 O-C-N 121.023 -1.048 . . . . 0.0 108.706 166.204 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 78.3 p -58.4 -42.24 86.69 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 123.657 0.783 . . . . 0.0 112.234 178.304 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 22.8 p -67.92 -47.71 67.99 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 125.533 1.533 . . . . 0.0 113.213 174.854 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 599' ' ' CYS . . . . . 0.43 ' HB2' ' HB2' ' A' ' 596' ' ' HIS . 86.4 m -60.65 -50.63 72.75 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 123.436 0.694 . . . . 0.0 111.493 179.732 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 88.2 t80 -56.07 -45.22 79.39 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 123.291 0.637 . . . . 0.0 112.135 178.227 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 22.7 t-160 -63.67 -46.56 84.99 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 112.939 0.718 . . . . 0.0 112.939 177.736 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 14.9 tm-20 -70.42 -33.4 71.3 Favored 'General case' 0 CA--C 1.543 0.702 0 O-C-N 121.502 -0.749 . . . . 0.0 112.649 -179.642 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 96.0 m . . . . . 0 N--CA 1.475 0.818 0 C-N-CA 124.619 1.168 . . . . 0.0 112.06 177.823 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 14.1 mm . . . . . 0 N--CA 1.476 0.849 0 N-CA-C 112.451 0.537 . . . . 0.0 112.451 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 32.8 ttm180 -61.33 -21.48 64.04 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 125.158 1.383 . . . . 0.0 113.924 178.051 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -71.85 -12.74 75.04 Favored Glycine 0 CA--C 1.539 1.566 0 N-CA-C 115.289 0.876 . . . . 0.0 115.289 177.271 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -70.96 147.91 48.22 Favored 'General case' 0 N--CA 1.478 0.944 0 CA-C-N 118.965 1.383 . . . . 0.0 112.129 177.844 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 46.8 p90 -152.59 165.81 34.01 Favored 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 114.008 1.114 . . . . 0.0 114.008 176.127 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 1.1 m -135.67 139.5 46.22 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.035 0 C-N-CA 126.757 2.023 . . . . 0.0 110.484 174.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 55.5 t -69.71 133.09 32.46 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.298 0 O-C-N 120.889 -1.132 . . . . 0.0 111.662 -176.021 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 95.0 t -69.37 124.17 89.91 Favored Pre-proline 0 N--CA 1.476 0.837 0 C-N-CA 124.725 1.21 . . . . 0.0 109.035 170.263 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 93.7 Cg_endo -78.35 143.48 19.68 Favored 'Trans proline' 0 CA--C 1.536 0.596 0 C-N-CA 123.152 2.568 . . . . 0.0 111.977 174.477 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -61.55 -24.76 66.86 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.08 0.952 . . . . 0.0 113.248 -179.559 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 58.6 p -72.18 -26.45 62.07 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 124.7 1.2 . . . . 0.0 113.523 177.207 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 39.7 m -80.85 88.94 5.82 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-N 119.336 0.971 . . . . 0.0 110.829 175.01 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 83.4 mt-30 -56.1 -30.97 62.82 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.205 1.402 . . . . 0.0 113.984 -176.694 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 69.4 m-20 -76.87 -21.73 54.51 Favored 'General case' 0 CA--C 1.545 0.784 0 N-CA-C 113.859 1.059 . . . . 0.0 113.859 178.257 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 66.8 mtp 51.3 32.67 8.62 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 126.105 1.762 . . . . 0.0 113.27 -173.488 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -147.97 154.12 39.91 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 124.691 1.196 . . . . 0.0 113.035 -170.346 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 6.9 t80 -153.94 155.64 36.0 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 124.922 1.289 . . . . 0.0 110.502 173.164 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 3.2 tmmm? -106.58 115.4 30.14 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 125.171 1.388 . . . . 0.0 111.985 -173.695 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 35.5 t -54.37 111.38 2.84 Favored Pre-proline 0 CA--C 1.545 0.768 0 C-N-CA 127.596 2.358 . . . . 0.0 111.279 174.876 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -62.74 -21.52 73.08 Favored 'Trans proline' 0 CA--C 1.539 0.755 0 C-N-CA 123.018 2.478 . . . . 0.0 114.957 178.894 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 96.7 mt -74.54 -57.56 6.34 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 C-N-CA 123.965 0.906 . . . . 0.0 111.164 -176.653 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 16.7 p -102.48 -0.94 31.54 Favored 'General case' 0 CA--C 1.551 0.986 0 N-CA-C 113.784 1.031 . . . . 0.0 113.784 -176.76 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 568' ' ' LYS . . . . . . . . . . . . . 32.9 mmtp 61.27 46.4 7.9 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 127.201 2.2 . . . . 0.0 112.985 -176.795 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 75.7 mt-10 -122.3 136.02 54.83 Favored 'General case' 0 N--CA 1.487 1.405 0 N-CA-C 114.737 1.384 . . . . 0.0 114.737 -173.916 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 79.2 m -83.49 116.85 22.73 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 112.896 0.702 . . . . 0.0 112.896 -179.016 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -85.27 147.56 5.43 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 C-N-CA 124.74 1.216 . . . . 0.0 110.116 167.068 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 58.4 p -133.32 151.37 51.87 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 125.636 1.574 . . . . 0.0 111.25 -179.37 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -70.15 158.53 53.5 Favored Glycine 0 CA--C 1.535 1.327 0 N-CA-C 114.965 0.746 . . . . 0.0 114.965 -176.034 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 9.2 p -140.52 143.37 29.26 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 125.099 1.36 . . . . 0.0 111.763 170.128 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 9.2 t80 -75.07 127.13 32.51 Favored 'General case' 0 CA--C 1.549 0.932 0 N-CA-C 113.905 1.076 . . . . 0.0 113.905 -173.922 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 37.7 t0 -97.85 101.19 12.63 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 125.812 1.645 . . . . 0.0 109.494 168.638 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -63.89 -26.61 68.68 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 124.651 1.181 . . . . 0.0 113.454 -179.194 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 73.2 mm-40 -78.03 -46.06 21.97 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 123.664 0.786 . . . . 0.0 112.468 -178.152 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 71.2 m -77.62 -29.36 51.76 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 123.446 0.698 . . . . 0.0 112.33 173.212 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 81.46 26.82 50.12 Favored Glycine 0 CA--C 1.534 1.257 0 C-N-CA 123.957 0.789 . . . . 0.0 112.963 -175.375 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 79.6 mm-40 -137.68 161.18 37.17 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 126.345 1.858 . . . . 0.0 110.148 -173.034 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 32.6 m95 -96.35 150.26 20.77 Favored 'General case' 0 CA--C 1.54 0.59 0 O-C-N 120.941 -1.1 . . . . 0.0 111.569 175.795 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 9.9 m -135.6 144.9 32.54 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 C-N-CA 125.299 1.44 . . . . 0.0 113.115 -173.686 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 3.2 m0 -92.0 104.86 17.22 Favored 'General case' 0 C--O 1.234 0.276 0 C-N-CA 126.67 1.988 . . . . 0.0 109.411 170.035 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -73.76 152.53 40.32 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 124.679 1.192 . . . . 0.0 112.104 178.421 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 54.73 29.86 12.49 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 125.519 1.527 . . . . 0.0 112.433 -177.662 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 62.0 m -125.05 149.22 48.01 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 124.517 1.127 . . . . 0.0 112.797 -169.303 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 14.9 tt -136.14 145.48 30.83 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.585 0 C-N-CA 127.906 2.482 . . . . 0.0 110.373 177.516 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 71.3 tt0 -107.77 123.48 48.61 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.659 1.184 . . . . 0.0 109.618 169.723 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 7.6 p -157.56 146.27 10.12 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 C-N-CA 124.774 1.23 . . . . 0.0 110.518 -177.028 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 8.2 t-20 52.88 35.19 18.36 Favored 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 124.642 1.177 . . . . 0.0 112.894 -175.649 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 68.67 14.39 67.29 Favored Glycine 0 CA--C 1.536 1.35 0 C-N-CA 125.5 1.524 . . . . 0.0 115.661 -178.291 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 35.9 mtmm -133.31 156.89 46.77 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 125.937 1.695 . . . . 0.0 111.456 -175.671 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 85.8 m-85 -90.74 147.26 23.36 Favored 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 113.001 0.741 . . . . 0.0 113.001 172.588 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 78.4 m-85 -150.44 160.72 43.56 Favored 'General case' 0 C--N 1.329 -0.326 0 C-N-CA 126.235 1.814 . . . . 0.0 110.043 -175.612 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 596' ' ' HIS . . . . . . . . . . . . . 26.0 m80 -75.2 139.08 42.4 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 108.486 -0.931 . . . . 0.0 108.486 167.136 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 59.2 p -59.91 -40.16 87.86 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.634 0.774 . . . . 0.0 111.812 177.653 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 9.4 p -71.25 -36.83 71.92 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 125.693 1.597 . . . . 0.0 113.113 176.72 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 599' ' ' CYS . . . . . . . . . . . . . 69.2 m -64.75 -59.48 4.18 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.353 1.061 . . . . 0.0 111.186 174.795 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 61.7 t80 -53.3 -41.51 65.7 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.363 1.065 . . . . 0.0 113.069 -177.179 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 83.2 t60 -61.4 -34.2 74.95 Favored 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 114.879 1.437 . . . . 0.0 114.879 -177.476 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 35.1 tp10 -102.22 -18.75 15.36 Favored 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 114.196 1.184 . . . . 0.0 114.196 -176.277 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 50.1 m . . . . . 0 N--CA 1.481 1.09 0 N-CA-C 115.993 1.849 . . . . 0.0 115.993 -167.977 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 30.0 mm . . . . . 0 CA--C 1.54 0.582 0 CA-C-O 120.824 0.345 . . . . 0.0 110.891 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 71.4 mtp180 -85.68 -20.8 28.84 Favored 'General case' 0 N--CA 1.481 1.1 0 N-CA-C 113.389 0.885 . . . . 0.0 113.389 -175.279 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -72.63 -10.97 76.92 Favored Glycine 0 CA--C 1.54 1.626 0 C-N-CA 125.467 1.508 . . . . 0.0 114.466 171.686 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 70.1 mmtt -66.34 140.12 58.07 Favored 'General case' 0 N--CA 1.477 0.918 0 CA-C-N 119.089 1.444 . . . . 0.0 111.747 173.271 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 46.1 p90 -153.79 164.86 37.64 Favored 'General case' 0 C--O 1.238 0.467 0 C-N-CA 124.253 1.021 . . . . 0.0 111.723 169.613 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -134.37 135.33 54.21 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 C-N-CA 125.563 1.545 . . . . 0.0 109.736 175.045 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 53.9 t -67.95 133.07 32.21 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.104 0 C-N-CA 123.741 0.816 . . . . 0.0 110.731 -177.349 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 553' ' ' VAL . . . . . 0.451 HG22 ' CD2' ' A' ' 584' ' ' TRP . 5.3 t -84.92 116.17 64.21 Favored Pre-proline 0 CA--C 1.541 0.61 0 C-N-CA 124.117 0.967 . . . . 0.0 109.84 173.805 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -76.69 163.33 31.76 Favored 'Trans proline' 0 CA--C 1.536 0.623 0 C-N-CA 122.509 2.139 . . . . 0.0 112.162 176.887 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 39.8 mm-40 -62.38 -28.64 69.91 Favored 'General case' 0 CA--C 1.548 0.895 0 O-C-N 121.296 -0.878 . . . . 0.0 112.562 173.04 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 69.7 p -67.59 -18.0 64.84 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 125.038 1.335 . . . . 0.0 113.322 175.793 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 18.2 m -80.81 -0.6 39.46 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 114.335 1.235 . . . . 0.0 114.335 169.684 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 88.4 mt-30 45.36 -84.43 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 128.571 2.748 . . . . 0.0 116.621 169.268 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 71.1 m-20 -70.83 -9.35 57.35 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 125.446 1.498 . . . . 0.0 113.914 178.738 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 12.1 mtt 57.99 31.14 20.23 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 126.002 1.721 . . . . 0.0 115.043 178.024 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -122.56 141.84 51.25 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 124.024 0.93 . . . . 0.0 112.943 -177.401 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -149.59 157.84 43.62 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 124.979 1.312 . . . . 0.0 111.436 179.703 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 39.2 ttpt -104.11 144.95 30.88 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 124.795 1.238 . . . . 0.0 114.197 -170.553 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 12.2 t -100.63 107.21 47.64 Favored Pre-proline 0 CA--C 1.541 0.632 0 C-N-CA 126.833 2.053 . . . . 0.0 108.607 166.943 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo -69.96 -16.96 36.91 Favored 'Trans proline' 0 CA--C 1.546 1.097 0 C-N-CA 122.502 2.134 . . . . 0.0 113.443 177.53 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 87.6 mt -72.9 -57.78 6.3 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 C-N-CA 124.12 0.968 . . . . 0.0 111.13 -178.957 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 15.5 p -98.11 -1.93 41.22 Favored 'General case' 0 CA--C 1.552 1.022 0 N-CA-C 113.648 0.981 . . . . 0.0 113.648 179.697 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 568' ' ' LYS . . . . . . . . . . . . . 45.6 tttt 59.73 45.84 12.37 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 126.522 1.929 . . . . 0.0 112.705 -177.736 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 70.3 mm-40 -117.59 166.09 12.79 Favored 'General case' 0 N--CA 1.482 1.149 0 N-CA-C 112.83 0.678 . . . . 0.0 112.83 -178.688 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 89.7 m -112.2 118.53 35.57 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.972 0.909 . . . . 0.0 111.199 179.34 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 3.5 m -79.53 138.58 19.71 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 123.486 0.715 . . . . 0.0 110.26 167.721 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 41.4 p -120.99 142.56 49.67 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 124.818 1.247 . . . . 0.0 110.077 176.307 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -65.92 144.15 46.15 Favored Glycine 0 CA--C 1.533 1.18 0 O-C-N 122.067 -0.395 . . . . 0.0 112.804 178.788 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 86.4 t -129.24 131.95 67.25 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 C-N-CA 125.237 1.415 . . . . 0.0 110.938 -178.901 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 71.5 t80 -71.82 117.49 13.48 Favored 'General case' 0 CA--C 1.549 0.912 0 CA-C-N 118.622 0.647 . . . . 0.0 112.315 -178.395 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 39.7 t0 -84.45 111.01 19.09 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.534 1.134 . . . . 0.0 109.469 169.016 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 54.5 mt-10 -68.9 -24.16 64.28 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 113.672 0.99 . . . . 0.0 113.672 -179.22 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 61.0 mt-10 -77.32 -42.0 38.43 Favored 'General case' 0 N--CA 1.475 0.788 0 O-C-N 121.207 -0.933 . . . . 0.0 112.908 -176.166 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 96.8 p -91.34 -24.74 19.7 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.852 0.861 . . . . 0.0 113.092 172.366 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 82.05 32.16 29.94 Favored Glycine 0 CA--C 1.533 1.159 0 C-N-CA 124.228 0.918 . . . . 0.0 113.124 -178.61 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 61.4 mm-40 -134.49 149.55 50.71 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 125.189 1.396 . . . . 0.0 111.439 -173.881 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 78.4 m95 -79.62 141.7 36.28 Favored 'General case' 0 CA--C 1.535 0.402 0 O-C-N 121.22 -0.925 . . . . 0.0 111.257 171.668 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 21.1 m -137.01 143.85 33.74 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 C-N-CA 125.703 1.601 . . . . 0.0 113.124 -174.973 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 584' ' ' TRP . . . . . 0.451 ' CD2' HG22 ' A' ' 553' ' ' VAL . 2.2 m0 -95.64 102.27 14.05 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 126.561 1.944 . . . . 0.0 107.739 170.37 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -79.32 148.75 31.98 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.873 1.269 . . . . 0.0 112.224 -176.873 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 61.0 t30 52.41 36.27 19.56 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.759 1.624 . . . . 0.0 112.805 -173.174 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 86.4 m -119.55 147.67 44.19 Favored 'General case' 0 N--CA 1.479 0.982 0 O-C-N 120.739 -1.226 . . . . 0.0 112.064 -172.589 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 8.9 tt -145.16 145.49 20.71 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.586 0 C-N-CA 127.312 2.245 . . . . 0.0 110.78 -177.123 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 63.0 tt0 -113.39 128.83 56.59 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.867 1.267 . . . . 0.0 109.417 168.009 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 7.5 p -152.52 135.9 7.8 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.832 0 C-N-CA 125.35 1.46 . . . . 0.0 110.636 -178.058 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 72.4 m-20 53.99 34.01 18.75 Favored 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 124.868 1.267 . . . . 0.0 113.756 -176.129 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 78.02 11.87 84.95 Favored Glycine 0 CA--C 1.537 1.465 0 C-N-CA 124.985 1.279 . . . . 0.0 115.484 -179.899 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -129.86 150.76 51.01 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 125.311 1.444 . . . . 0.0 111.559 -178.528 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 14.2 m-85 -93.48 147.21 23.18 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.611 1.165 . . . . 0.0 112.238 177.749 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 95.3 m-85 -154.08 165.08 37.31 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 126.027 1.731 . . . . 0.0 111.176 -177.248 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 596' ' ' HIS . . . . . 0.431 ' HB2' ' HB2' ' A' ' 599' ' ' CYS . 21.5 m80 -79.32 142.45 36.08 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 108.142 -1.058 . . . . 0.0 108.142 165.424 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 7.8 t -66.56 -39.06 88.33 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 118.997 0.817 . . . . 0.0 112.012 -178.144 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 21.7 p -63.4 -44.53 94.38 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.109 0.963 . . . . 0.0 112.974 171.781 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 599' ' ' CYS . . . . . 0.431 ' HB2' ' HB2' ' A' ' 596' ' ' HIS . 93.1 m -62.32 -50.96 69.56 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.042 0.937 . . . . 0.0 111.044 177.367 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 56.9 t80 -57.37 -43.75 83.84 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 123.778 0.831 . . . . 0.0 111.889 176.517 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 84.4 t60 -62.55 -40.76 97.86 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 123.64 0.776 . . . . 0.0 112.718 178.454 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 73.3 mm-40 -69.28 -36.86 77.52 Favored 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 113.46 0.911 . . . . 0.0 113.46 173.496 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 71.4 m . . . . . 0 N--CA 1.477 0.915 0 C-N-CA 124.077 0.951 . . . . 0.0 112.369 -176.883 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 23.3 mm . . . . . 0 N--CA 1.474 0.756 0 CA-C-O 120.255 0.074 . . . . 0.0 111.173 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 21.2 mmt85 -65.54 -36.65 84.42 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 124.526 1.131 . . . . 0.0 112.321 176.682 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -68.4 -14.27 66.47 Favored Glycine 0 CA--C 1.528 0.901 0 C-N-CA 126.215 1.864 . . . . 0.0 114.278 -179.886 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 65.7 mmtt -76.6 95.26 3.9 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 118.731 1.265 . . . . 0.0 108.659 168.799 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 30.9 p90 -105.91 162.0 13.96 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 113.736 -1.575 . . . . 0.0 111.814 170.353 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 4.3 m -127.85 142.25 44.21 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.617 0 C-N-CA 125.912 1.685 . . . . 0.0 109.803 172.042 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 94.5 t -69.19 135.32 28.59 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 O-C-N 121.606 -0.684 . . . . 0.0 110.742 -176.656 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 97.5 t -68.98 119.73 71.67 Favored Pre-proline 0 CA--C 1.545 0.752 0 C-N-CA 124.04 0.936 . . . . 0.0 108.985 173.283 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo -76.21 154.67 37.07 Favored 'Trans proline' 0 CA--C 1.535 0.568 0 C-N-CA 123.189 2.593 . . . . 0.0 112.472 -177.556 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 17.3 pt-20 -65.3 -17.29 64.39 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 113.199 0.814 . . . . 0.0 113.199 173.779 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 77.4 p -73.09 -22.39 60.58 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.113 0.965 . . . . 0.0 113.005 173.807 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 30.5 t -79.2 110.38 14.41 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 119.281 0.946 . . . . 0.0 110.889 173.578 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 26.5 mp0 -71.95 -31.11 66.0 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.208 1.003 . . . . 0.0 112.53 -178.635 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 66.6 m-20 -108.71 -2.8 18.36 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 125.508 1.523 . . . . 0.0 113.998 -174.793 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 7.4 mtt 55.22 37.53 29.04 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.524 1.53 . . . . 0.0 112.889 -171.718 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -133.02 142.19 48.68 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.312 1.045 . . . . 0.0 113.292 -173.338 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 28.0 t80 -152.63 159.76 43.2 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 125.799 1.64 . . . . 0.0 109.789 174.09 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 38.8 ttmt -118.16 134.71 54.75 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 124.583 1.153 . . . . 0.0 113.737 -170.429 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 19.6 t -73.03 116.78 53.96 Favored Pre-proline 0 CA--C 1.541 0.617 0 C-N-CA 126.104 1.762 . . . . 0.0 110.509 169.308 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 93.2 Cg_endo -71.77 -18.04 28.8 Favored 'Trans proline' 0 CA--C 1.543 0.951 0 C-N-CA 122.892 2.394 . . . . 0.0 113.974 173.315 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 73.6 mt -72.04 -56.67 9.37 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 C-N-CA 123.948 0.899 . . . . 0.0 110.413 -177.456 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 15.6 p -100.99 -0.67 36.11 Favored 'General case' 0 CA--C 1.552 1.055 0 N-CA-C 113.911 1.078 . . . . 0.0 113.911 178.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 568' ' ' LYS . . . . . . . . . . . . . 33.6 tttt 63.73 39.61 8.42 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 126.644 1.978 . . . . 0.0 113.824 -179.041 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 78.6 mm-40 -123.59 138.49 54.54 Favored 'General case' 0 N--CA 1.481 1.099 0 N-CA-C 114.136 1.161 . . . . 0.0 114.136 -171.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 80.5 m -83.64 122.48 28.66 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 124.589 1.155 . . . . 0.0 112.42 -179.28 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 1.7 t -79.33 141.49 15.29 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 C-N-CA 124.715 1.206 . . . . 0.0 109.223 168.106 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 43.1 p -113.66 138.72 49.81 Favored 'General case' 0 N--CA 1.475 0.825 0 C-N-CA 124.67 1.188 . . . . 0.0 109.997 169.28 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -65.97 150.8 51.94 Favored Glycine 0 CA--C 1.535 1.287 0 C-N-CA 124.756 1.169 . . . . 0.0 113.756 -178.44 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 84.3 t -138.05 133.7 44.31 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.858 0 C-N-CA 125.747 1.619 . . . . 0.0 111.598 -176.291 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 70.2 t80 -69.27 141.75 54.29 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-N 119.742 1.156 . . . . 0.0 113.039 179.067 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -126.6 130.64 50.9 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.543 1.137 . . . . 0.0 111.445 172.788 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 80.9 mt-10 -71.72 -25.79 62.22 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 113.541 0.941 . . . . 0.0 113.541 176.848 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -74.23 -42.13 60.23 Favored 'General case' 0 N--CA 1.479 1.023 0 CA-C-N 118.98 0.809 . . . . 0.0 111.481 177.859 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 33.1 m -75.11 -31.57 61.17 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 124.302 1.041 . . . . 0.0 112.029 171.037 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 71.39 22.25 78.59 Favored Glycine 0 CA--C 1.534 1.226 0 C-N-CA 123.959 0.79 . . . . 0.0 112.265 -169.74 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -153.82 166.95 31.29 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 126.382 1.873 . . . . 0.0 112.13 -169.406 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 70.2 m95 -76.69 142.99 40.34 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.728 1.211 . . . . 0.0 111.893 175.718 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 28.9 m -139.74 148.09 23.4 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 C-N-CA 126.663 1.985 . . . . 0.0 112.086 -172.906 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 4.7 m0 -97.71 98.98 10.33 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 127.386 2.275 . . . . 0.0 107.598 170.851 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 66.3 mttm -75.22 154.4 37.57 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 124.412 1.085 . . . . 0.0 111.525 179.808 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 62.1 t30 49.59 40.23 19.0 Favored 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 125.087 1.355 . . . . 0.0 112.411 -174.509 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 96.8 m -130.12 137.94 50.41 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 124.835 1.254 . . . . 0.0 111.383 -175.921 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 11.1 tt -133.75 140.13 47.2 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 C-N-CA 126.363 1.865 . . . . 0.0 112.121 -168.989 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 69.2 tt0 -97.51 132.34 43.29 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.502 1.121 . . . . 0.0 110.621 169.863 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 7.7 p -145.79 127.57 8.35 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.616 0 C-N-CA 125.352 1.461 . . . . 0.0 111.02 171.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 61.9 m-20 53.3 36.81 23.75 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 124.993 1.317 . . . . 0.0 113.828 175.372 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 79.67 8.5 87.67 Favored Glycine 0 CA--C 1.539 1.575 0 C-N-CA 124.67 1.129 . . . . 0.0 115.383 -179.368 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 58.9 mtmt -123.5 160.69 26.41 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 126.29 1.836 . . . . 0.0 111.114 178.247 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 75.3 m-85 -113.27 143.19 44.84 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 124.177 0.991 . . . . 0.0 113.635 179.832 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 21.5 m-30 -139.93 171.82 13.66 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 128.247 2.619 . . . . 0.0 109.77 179.709 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 596' ' ' HIS . . . . . 0.435 ' HB2' ' HB2' ' A' ' 599' ' ' CYS . 20.0 m80 -83.79 143.05 30.22 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 107.976 -1.12 . . . . 0.0 107.976 166.409 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 11.3 m -65.26 -41.35 94.35 Favored 'General case' 0 N--CA 1.473 0.68 0 O-C-N 122.089 -0.382 . . . . 0.0 111.897 -176.72 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 21.3 p -65.55 -42.01 92.36 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-O 118.561 -0.733 . . . . 0.0 112.843 171.84 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 599' ' ' CYS . . . . . 0.435 ' HB2' ' HB2' ' A' ' 596' ' ' HIS . 67.4 m -59.83 -54.02 51.17 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 119.301 0.955 . . . . 0.0 111.605 178.883 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -54.73 -51.83 64.4 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 123.246 0.618 . . . . 0.0 109.929 175.093 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 85.8 t60 -56.71 -45.86 81.61 Favored 'General case' 0 N--CA 1.47 0.542 0 N-CA-C 114.222 1.193 . . . . 0.0 114.222 -179.607 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -80.49 -26.91 37.92 Favored 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 113.946 1.091 . . . . 0.0 113.946 -179.176 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 93.0 m . . . . . 0 N--CA 1.482 1.128 0 C-N-CA 123.936 0.895 . . . . 0.0 112.109 -177.854 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 22.3 mm . . . . . 0 N--CA 1.476 0.849 0 N-CA-C 113.032 0.753 . . . . 0.0 113.032 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 23.4 ptt180 -72.11 -17.79 61.95 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 113.661 0.986 . . . . 0.0 113.661 -176.625 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -75.62 -11.39 84.47 Favored Glycine 0 CA--C 1.535 1.33 0 C-N-CA 124.856 1.217 . . . . 0.0 114.165 -178.071 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -70.56 131.69 44.37 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 118.565 1.182 . . . . 0.0 110.732 174.766 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 50.0 p90 -140.58 163.94 31.51 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 124.79 1.236 . . . . 0.0 111.967 174.624 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 21.3 m -127.92 143.29 41.28 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 C-N-CA 126.004 1.721 . . . . 0.0 109.733 172.689 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 92.3 t -69.67 134.61 29.84 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.149 0 O-C-N 120.662 -1.274 . . . . 0.0 109.747 175.644 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 85.7 t -63.27 122.96 78.83 Favored Pre-proline 0 CA--C 1.544 0.746 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 179.137 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -72.85 151.07 50.61 Favored 'Trans proline' 0 CA--C 1.538 0.681 0 C-N-CA 122.572 2.182 . . . . 0.0 112.684 -175.595 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 16.0 pt-20 -62.61 -21.01 65.32 Favored 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 113.87 1.063 . . . . 0.0 113.87 179.359 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 45.8 p -74.68 -30.18 61.48 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 125.629 1.572 . . . . 0.0 113.208 176.014 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 62.3 m -87.19 79.76 8.49 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 123.617 0.767 . . . . 0.0 112.006 -177.911 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 85.9 mt-30 -58.4 -32.97 69.13 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 125.138 1.375 . . . . 0.0 113.501 -177.702 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 16.6 t0 -77.65 -12.47 59.97 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 124.764 1.226 . . . . 0.0 113.297 176.604 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 6.5 mtt 52.75 35.99 20.02 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 126.135 1.774 . . . . 0.0 113.364 -175.978 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -142.05 149.73 40.33 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.364 1.065 . . . . 0.0 112.47 -178.221 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 9.3 t80 -153.32 155.24 36.12 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 124.01 0.924 . . . . 0.0 110.825 177.329 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 28.3 ttpp -99.85 134.31 42.95 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 123.969 0.908 . . . . 0.0 113.27 -175.47 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 40.7 t -76.27 116.13 53.34 Favored Pre-proline 0 CA--C 1.541 0.614 0 C-N-CA 127.006 2.122 . . . . 0.0 110.622 169.286 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -62.66 -28.31 76.67 Favored 'Trans proline' 0 CA--C 1.542 0.901 0 C-N-CA 122.708 2.272 . . . . 0.0 114.597 175.686 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 87.3 mt -70.6 -60.47 2.41 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.2 0 CA-C-N 118.845 0.748 . . . . 0.0 111.427 -174.54 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 15.6 p -93.72 -1.99 54.39 Favored 'General case' 0 CA--C 1.549 0.929 0 N-CA-C 113.596 0.961 . . . . 0.0 113.596 179.837 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 568' ' ' LYS . . . . . . . . . . . . . 2.2 mptp? 60.48 43.47 13.06 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 126.959 2.104 . . . . 0.0 112.205 -177.417 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 75.0 mm-40 -123.31 140.73 52.71 Favored 'General case' 0 N--CA 1.482 1.134 0 N-CA-C 114.401 1.26 . . . . 0.0 114.401 -173.645 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 97.5 m -82.06 116.74 21.79 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 123.863 0.865 . . . . 0.0 111.817 179.078 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 2.9 p -79.56 149.47 5.36 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.885 0 C-N-CA 124.411 1.084 . . . . 0.0 110.076 167.949 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 44.5 p -126.07 142.8 51.37 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 124.816 1.246 . . . . 0.0 111.319 -179.376 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -72.81 147.11 39.48 Favored Glycine 0 CA--C 1.529 0.932 0 C-N-CA 124.758 1.171 . . . . 0.0 112.893 -178.291 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 62.5 t -135.09 130.23 51.47 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.421 0 C-N-CA 124.583 1.153 . . . . 0.0 111.749 -178.979 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 68.5 t80 -68.39 115.78 8.21 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 122.993 0.517 . . . . 0.0 112.078 178.354 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 37.2 t0 -86.44 119.4 26.66 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 123.89 0.876 . . . . 0.0 110.006 169.386 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 63.7 mt-10 -69.25 -23.1 63.81 Favored 'General case' 0 CA--C 1.548 0.869 0 N-CA-C 113.2 0.815 . . . . 0.0 113.2 177.18 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 8.4 tm-20 -79.78 -47.76 14.69 Favored 'General case' 0 CA--C 1.541 0.61 0 O-C-N 121.211 -0.931 . . . . 0.0 111.724 -179.38 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 47.7 m -71.94 -28.42 63.45 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.775 0.83 . . . . 0.0 112.379 169.953 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 75.21 24.27 71.71 Favored Glycine 0 CA--C 1.533 1.212 0 C-N-CA 124.686 1.136 . . . . 0.0 113.933 -173.538 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -148.13 159.86 43.49 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 125.983 1.713 . . . . 0.0 111.812 -170.791 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 73.7 m95 -76.87 139.69 40.34 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 123.922 0.889 . . . . 0.0 111.731 -179.894 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 16.8 m -132.87 150.43 32.95 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 126.039 1.736 . . . . 0.0 112.591 -179.181 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 7.8 m0 -100.15 101.43 12.47 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 127.409 2.283 . . . . 0.0 107.829 173.079 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 73.8 mmtt -70.71 151.75 44.57 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 124.986 1.314 . . . . 0.0 111.56 -178.688 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 59.4 t30 49.57 40.4 19.3 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 125.442 1.497 . . . . 0.0 112.962 -177.862 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 99.9 m -123.86 147.74 47.37 Favored 'General case' 0 N--CA 1.485 1.309 0 O-C-N 121.005 -1.06 . . . . 0.0 112.476 -171.232 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 16.4 tt -142.55 148.73 19.67 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.631 0 C-N-CA 127.75 2.42 . . . . 0.0 110.049 -178.169 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 69.5 tt0 -108.34 130.47 55.2 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.421 1.088 . . . . 0.0 110.784 170.294 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 9.4 p -153.31 145.47 14.79 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.911 0 C-N-CA 125.06 1.344 . . . . 0.0 110.503 177.069 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 8.1 t-20 53.59 30.94 11.62 Favored 'General case' 0 CA--C 1.552 1.028 0 C-N-CA 124.944 1.297 . . . . 0.0 113.571 -177.655 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 76.6 11.22 85.43 Favored Glycine 0 CA--C 1.539 1.585 0 C-N-CA 124.976 1.274 . . . . 0.0 115.916 -179.323 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -135.25 161.03 36.55 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 125.914 1.686 . . . . 0.0 112.365 -179.75 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 69.6 m-85 -90.05 150.24 22.18 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 113.684 0.994 . . . . 0.0 113.684 178.258 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 89.1 m-85 -149.94 163.28 38.51 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 127.382 2.273 . . . . 0.0 109.955 -176.63 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 596' ' ' HIS . . . . . 0.403 ' HB2' ' HB2' ' A' ' 599' ' ' CYS . 29.4 m80 -81.07 140.61 35.0 Favored 'General case' 0 N--CA 1.471 0.602 0 O-C-N 121.343 -0.848 . . . . 0.0 109.224 168.716 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 23.6 t -62.62 -45.43 92.88 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 123.353 0.661 . . . . 0.0 112.02 -178.695 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 24.5 p -63.36 -44.34 95.1 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 123.871 0.868 . . . . 0.0 112.777 173.929 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 599' ' ' CYS . . . . . 0.403 ' HB2' ' HB2' ' A' ' 596' ' ' HIS . 97.2 m -57.77 -53.57 56.72 Favored 'General case' 0 CA--C 1.544 0.72 0 CA-C-N 119.134 0.879 . . . . 0.0 111.404 176.897 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 80.9 t80 -57.82 -45.79 85.63 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.335 1.054 . . . . 0.0 112.308 177.367 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 48.1 t-80 -62.9 -43.05 99.84 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 124.005 0.922 . . . . 0.0 113.011 177.628 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 62.9 mt-10 -73.0 -30.38 63.74 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 123.867 0.867 . . . . 0.0 113.117 178.342 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 51.5 m . . . . . 0 N--CA 1.477 0.921 0 C-N-CA 124.267 1.027 . . . . 0.0 112.13 175.01 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 24.0 mm . . . . . 0 N--CA 1.479 1.003 0 N-CA-C 111.324 0.12 . . . . 0.0 111.324 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 88.8 mtt-85 -70.1 -30.38 67.59 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 124.105 0.962 . . . . 0.0 112.959 176.905 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -79.73 -9.47 86.77 Favored Glycine 0 CA--C 1.536 1.369 0 C-N-CA 125.637 1.589 . . . . 0.0 114.535 178.572 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 58.9 mtpt -75.64 132.62 40.73 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.719 1.207 . . . . 0.0 111.154 177.063 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 23.5 p90 -153.3 166.55 32.24 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 125.234 1.414 . . . . 0.0 111.387 176.141 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -130.89 133.72 62.69 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 C-N-CA 124.915 1.286 . . . . 0.0 110.483 175.671 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 73.4 t -64.15 134.34 29.04 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 C-N-CA 124.168 0.987 . . . . 0.0 110.405 -178.152 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 59.0 t -70.97 116.5 47.07 Favored Pre-proline 0 CA--C 1.544 0.739 0 CA-C-O 118.627 -0.702 . . . . 0.0 109.467 173.741 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -83.37 154.8 14.21 Favored 'Trans proline' 0 N--CA 1.457 -0.642 0 C-N-CA 123.546 2.831 . . . . 0.0 111.607 179.949 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 3.9 pm0 -64.37 -22.39 66.94 Favored 'General case' 0 N--CA 1.471 0.577 0 O-C-N 121.089 -1.007 . . . . 0.0 112.675 174.435 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 67.6 p -71.85 -17.65 62.12 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 125.131 1.372 . . . . 0.0 113.064 175.936 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 61.0 p -74.05 -35.53 64.29 Favored 'General case' 0 N--CA 1.48 1.066 0 CA-C-N 119.278 0.945 . . . . 0.0 112.177 175.811 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 57.3 tt0 59.76 -49.17 0.08 Allowed 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 129.94 3.296 . . . . 0.0 115.994 -177.366 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 71.8 m-20 -80.23 -11.15 59.76 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.6 1.56 . . . . 0.0 113.883 177.719 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 63.5 mtp 57.59 27.19 13.8 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 125.889 1.675 . . . . 0.0 114.517 -179.3 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -145.83 147.65 32.05 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.327 1.051 . . . . 0.0 113.483 -175.421 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 40.2 m-85 -149.79 164.97 33.87 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 127.051 2.14 . . . . 0.0 110.276 175.304 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 38.1 ttmt -114.09 132.04 56.18 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 124.496 1.119 . . . . 0.0 112.815 -177.881 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 13.1 t -66.94 112.67 10.34 Favored Pre-proline 0 CA--C 1.542 0.655 0 C-N-CA 126.284 1.834 . . . . 0.0 109.744 168.437 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -70.16 -18.87 34.84 Favored 'Trans proline' 0 CA--C 1.54 0.796 0 C-N-CA 122.5 2.134 . . . . 0.0 113.024 176.494 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 36.5 mt -70.93 -50.11 45.32 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 C-N-CA 124.839 1.256 . . . . 0.0 110.968 -175.886 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 15.6 p -108.55 -2.09 19.15 Favored 'General case' 0 CA--C 1.552 1.028 0 C-N-CA 124.906 1.283 . . . . 0.0 113.607 178.425 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 568' ' ' LYS . . . . . . . . . . . . . 96.0 mttt 60.44 46.59 9.63 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 126.913 2.085 . . . . 0.0 112.697 -177.507 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 72.1 mm-40 -126.04 141.88 51.76 Favored 'General case' 0 N--CA 1.481 1.078 0 N-CA-C 114.688 1.366 . . . . 0.0 114.688 -176.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 93.7 m -86.23 130.56 34.48 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 123.781 0.832 . . . . 0.0 112.979 -176.535 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 3.0 m -94.78 151.43 3.82 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.891 0 C-N-CA 125.779 1.631 . . . . 0.0 111.088 167.514 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 65.8 p -134.15 149.52 51.05 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 125.414 1.486 . . . . 0.0 111.27 178.158 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -67.69 143.8 42.67 Favored Glycine 0 CA--C 1.536 1.363 0 C-N-CA 124.219 0.914 . . . . 0.0 114.868 -177.42 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 98.8 t -139.67 136.0 39.51 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 125.596 1.558 . . . . 0.0 112.091 -179.703 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 75.2 t80 -73.25 123.58 23.99 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 120.241 1.382 . . . . 0.0 112.97 -177.262 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 16.1 t0 -91.62 123.01 34.7 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 125.641 1.576 . . . . 0.0 111.274 169.979 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -72.37 -24.59 61.29 Favored 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 114.131 1.16 . . . . 0.0 114.131 177.125 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -73.84 -53.74 9.55 Favored 'General case' 0 N--CA 1.476 0.826 0 CA-C-N 119.09 0.859 . . . . 0.0 111.661 -176.299 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 15.4 t -78.6 -27.46 45.55 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 123.831 0.853 . . . . 0.0 112.201 172.749 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 79.45 32.54 37.83 Favored Glycine 0 CA--C 1.532 1.144 0 C-N-CA 124.032 0.825 . . . . 0.0 113.2 -175.754 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 77.6 mm-40 -141.49 155.92 45.79 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.73 1.612 . . . . 0.0 111.777 -170.421 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 79.7 m95 -76.08 138.32 40.74 Favored 'General case' 0 CA--C 1.534 0.358 0 O-C-N 120.967 -1.083 . . . . 0.0 111.468 173.584 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 18.7 m -138.8 151.03 23.62 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.019 0 C-N-CA 126.657 1.983 . . . . 0.0 113.002 -173.273 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 4.3 m0 -94.93 104.19 16.07 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 126.376 1.87 . . . . 0.0 108.639 168.632 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 53.9 mtmt -69.5 145.87 52.34 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 124.305 1.042 . . . . 0.0 111.443 -177.487 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 48.0 t30 48.96 44.76 22.65 Favored 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 125.326 1.45 . . . . 0.0 112.194 -178.236 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 87.9 m -131.77 146.35 52.1 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 124.528 1.131 . . . . 0.0 111.993 -173.058 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 13.0 tt -139.66 151.79 22.53 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.724 0 C-N-CA 127.967 2.507 . . . . 0.0 109.979 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 81.0 tt0 -107.93 117.77 35.01 Favored 'General case' 0 N--CA 1.472 0.67 0 O-C-N 120.889 -1.132 . . . . 0.0 110.734 172.099 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 5.0 t -144.18 138.38 24.13 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 C-N-CA 125.511 1.524 . . . . 0.0 110.506 -175.567 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 14.5 m120 54.39 34.49 20.9 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 124.973 1.309 . . . . 0.0 113.678 -179.57 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 75.77 11.27 84.68 Favored Glycine 0 CA--C 1.536 1.4 0 C-N-CA 124.773 1.178 . . . . 0.0 115.58 -179.329 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 64.1 mttp -132.21 157.08 45.24 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 125.96 1.704 . . . . 0.0 111.614 -179.298 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 74.8 m-85 -88.38 130.97 35.02 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 121.685 0.755 . . . . 0.0 111.566 174.241 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 12.1 m-30 -124.72 156.68 37.25 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 127.104 2.162 . . . . 0.0 109.696 -176.523 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 596' ' ' HIS . . . . . 0.406 ' HB2' ' HB2' ' A' ' 599' ' ' CYS . 29.6 m80 -79.87 140.98 36.55 Favored 'General case' 0 N--CA 1.47 0.573 0 O-C-N 120.837 -1.164 . . . . 0.0 108.184 167.085 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 19.1 m -66.8 -38.31 86.26 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 118.841 0.746 . . . . 0.0 112.262 -179.251 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 23.4 p -65.65 -37.86 87.72 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 123.872 0.869 . . . . 0.0 113.187 172.042 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 599' ' ' CYS . . . . . 0.406 ' HB2' ' HB2' ' A' ' 596' ' ' HIS . 68.0 m -61.71 -58.63 7.28 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 123.881 0.872 . . . . 0.0 110.089 172.7 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 58.1 t80 -53.48 -39.64 64.69 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 125.329 1.452 . . . . 0.0 113.517 -179.782 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 82.1 t60 -60.79 -27.16 67.81 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 113.85 1.056 . . . . 0.0 113.85 177.619 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 57.7 mm-40 -109.36 -7.95 15.14 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 125.571 1.549 . . . . 0.0 114.258 -179.958 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 19.3 m . . . . . 0 N--CA 1.476 0.85 0 C-N-CA 124.572 1.149 . . . . 0.0 113.082 -173.857 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 34.9 mm . . . . . 0 CA--C 1.547 0.835 0 N-CA-C 111.824 0.305 . . . . 0.0 111.824 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . 0.269 0.0 OUTLIER -76.27 -13.94 60.14 Favored 'General case' 0 N--CA 1.486 1.347 0 O-C-N 120.505 -1.372 . . . . 0.0 113.54 175.856 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -70.6 -12.95 70.91 Favored Glycine 0 CA--C 1.537 1.414 0 C-N-CA 124.751 1.167 . . . . 0.0 113.9 170.914 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 32.0 mmtp -75.03 127.6 33.61 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 118.767 1.283 . . . . 0.0 110.364 171.245 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 39.9 p90 -149.62 164.24 35.68 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 123.854 0.861 . . . . 0.0 112.713 173.737 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -134.24 133.15 55.63 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 C-N-CA 126.15 1.78 . . . . 0.0 109.644 174.634 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 53.8 t -67.23 135.28 28.83 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.94 0 C-N-CA 123.774 0.83 . . . . 0.0 110.834 -176.72 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 19.0 t -74.28 116.21 50.58 Favored Pre-proline 0 N--CA 1.474 0.729 0 N-CA-C 108.518 -0.919 . . . . 0.0 108.518 171.523 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_endo -77.05 151.13 30.33 Favored 'Trans proline' 0 N--CA 1.458 -0.586 0 C-N-CA 122.752 2.301 . . . . 0.0 111.302 175.456 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -62.65 -22.36 66.38 Favored 'General case' 0 N--CA 1.477 0.876 0 O-C-N 121.376 -0.827 . . . . 0.0 112.942 175.069 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 20.6 m -64.32 -28.32 69.63 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 125.353 1.461 . . . . 0.0 113.487 171.685 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 42.3 t -78.14 125.97 30.13 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 123.934 0.894 . . . . 0.0 112.181 179.639 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 1.7 pm0 -81.31 152.66 27.45 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.363 1.065 . . . . 0.0 111.868 170.197 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 36.3 m-20 60.75 -11.93 0.05 OUTLIER 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 127.642 2.377 . . . . 0.0 117.365 176.848 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 46.9 mtp 57.34 32.76 22.29 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 126.098 1.759 . . . . 0.0 114.194 173.448 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -151.33 155.54 38.92 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.827 1.251 . . . . 0.0 112.797 -171.674 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -152.97 154.44 34.99 Favored 'General case' 0 CA--C 1.542 0.673 0 N-CA-C 113.09 0.774 . . . . 0.0 113.09 173.237 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 14.5 tptm -77.88 142.0 38.74 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 125.107 1.363 . . . . 0.0 113.226 -178.116 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 14.8 t -94.45 107.25 28.47 Favored Pre-proline 0 CA--C 1.539 0.554 0 C-N-CA 125.165 1.386 . . . . 0.0 108.979 167.736 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 63.9 Cg_endo -67.66 -19.58 47.67 Favored 'Trans proline' 0 CA--C 1.542 0.905 0 C-N-CA 122.162 1.908 . . . . 0.0 113.529 175.851 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 89.0 mt -73.48 -56.86 8.12 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 C-N-CA 124.365 1.066 . . . . 0.0 111.178 -176.473 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 14.9 p -100.17 0.3 40.25 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 124.488 1.115 . . . . 0.0 113.794 179.242 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 568' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 59.58 44.32 14.73 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 126.818 2.047 . . . . 0.0 112.122 -179.423 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 74.7 mm-40 -115.59 -175.35 2.7 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 123.774 0.83 . . . . 0.0 112.154 179.857 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 60.6 m -125.6 128.66 48.24 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 124.403 1.081 . . . . 0.0 110.586 172.078 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 2.3 p -91.83 147.15 5.49 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 C-N-CA 124.357 1.063 . . . . 0.0 111.062 170.161 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 64.3 p -133.4 145.91 50.74 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 124.826 1.25 . . . . 0.0 111.753 -175.299 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -72.04 153.6 49.98 Favored Glycine 0 CA--C 1.537 1.413 0 C-N-CA 124.275 0.941 . . . . 0.0 113.63 -179.939 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 8.8 p -142.69 138.06 28.13 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 C-N-CA 124.362 1.065 . . . . 0.0 112.383 177.972 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 68.9 t80 -71.71 118.37 14.46 Favored 'General case' 0 CA--C 1.544 0.732 0 O-C-N 121.497 -0.752 . . . . 0.0 112.295 -178.364 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 21.8 t0 -85.22 120.9 27.23 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.32 1.048 . . . . 0.0 110.493 170.158 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 53.2 mt-10 -74.36 -22.91 59.0 Favored 'General case' 0 CA--C 1.54 0.565 0 N-CA-C 113.765 1.024 . . . . 0.0 113.765 -178.812 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 34.1 mm-40 -76.52 -51.17 12.22 Favored 'General case' 0 N--CA 1.476 0.849 0 CA-C-N 119.467 1.03 . . . . 0.0 112.998 177.203 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 15.7 t -75.07 -27.44 59.94 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 123.47 0.708 . . . . 0.0 112.071 173.736 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 75.49 32.18 55.32 Favored Glycine 0 CA--C 1.535 1.324 0 C-N-CA 124.829 1.204 . . . . 0.0 112.655 -175.002 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -143.94 150.44 38.35 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 125.506 1.522 . . . . 0.0 112.133 -170.863 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 84.7 m95 -73.71 138.97 45.0 Favored 'General case' 0 CA--C 1.537 0.474 0 O-C-N 121.288 -0.883 . . . . 0.0 111.904 175.429 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 5.5 m -134.84 141.58 42.72 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 C-N-CA 126.115 1.766 . . . . 0.0 112.9 -177.419 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 4.7 m0 -87.51 102.94 15.06 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.739 1.616 . . . . 0.0 108.854 169.338 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 73.5 mmtt -72.8 147.54 45.4 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 123.867 0.867 . . . . 0.0 111.628 -178.581 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 51.3 t30 50.45 43.76 27.0 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.959 1.304 . . . . 0.0 112.271 -177.983 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 93.0 m -126.2 147.19 49.71 Favored 'General case' 0 N--CA 1.48 1.057 0 O-C-N 120.774 -1.203 . . . . 0.0 112.899 -172.095 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 5.6 tt -139.65 144.87 27.75 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.672 0 C-N-CA 127.663 2.385 . . . . 0.0 109.668 179.964 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 87.0 tt0 -117.46 121.04 39.96 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 124.977 1.311 . . . . 0.0 110.198 173.47 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 5.2 t -142.88 131.16 19.96 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.509 0 C-N-CA 125.96 1.704 . . . . 0.0 109.746 -175.164 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 71.5 m-20 52.22 44.72 29.45 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 125.223 1.409 . . . . 0.0 112.737 174.953 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 73.33 9.85 77.93 Favored Glycine 0 CA--C 1.536 1.363 0 C-N-CA 125.157 1.36 . . . . 0.0 115.507 178.915 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 35.9 mtmm -128.58 151.86 48.97 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 126.085 1.754 . . . . 0.0 112.007 -176.415 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 69.4 m-85 -96.72 148.59 22.73 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 124.098 0.959 . . . . 0.0 112.88 174.211 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 65.3 m-85 -149.13 160.1 43.65 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.177 1.391 . . . . 0.0 110.578 177.748 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 596' ' ' HIS . . . . . . . . . . . . . 20.8 m170 -75.19 142.23 43.5 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 167.628 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 8.7 t -67.54 -42.23 83.0 Favored 'General case' 0 N--CA 1.469 0.505 0 O-C-N 121.388 -0.82 . . . . 0.0 111.867 -179.273 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 21.6 p -60.32 -38.76 84.74 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.661 0.785 . . . . 0.0 113.096 173.471 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 599' ' ' CYS . . . . . . . . . . . . . 95.1 m -68.35 -57.61 5.65 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.161 0.984 . . . . 0.0 110.727 177.385 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 54.7 t80 -65.56 -33.51 76.09 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 113.064 0.764 . . . . 0.0 113.064 -175.246 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 82.0 t60 -58.18 -36.88 73.71 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 124.742 1.217 . . . . 0.0 113.108 175.315 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 94.8 mt-10 -89.78 -26.26 20.68 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 113.648 0.981 . . . . 0.0 113.648 176.329 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 83.0 m . . . . . 0 N--CA 1.478 0.942 0 C-N-CA 124.121 0.968 . . . . 0.0 113.096 -175.037 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 5.9 mm . . . . . 0 N--CA 1.478 0.928 0 CA-C-O 120.513 0.197 . . . . 0.0 111.212 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 38.4 ptt180 -64.4 -22.68 67.03 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 125.145 1.378 . . . . 0.0 114.148 176.816 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -81.25 -9.36 86.11 Favored Glycine 0 CA--C 1.533 1.164 0 C-N-CA 125.63 1.586 . . . . 0.0 114.47 -177.597 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -70.45 143.62 51.72 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 118.348 1.074 . . . . 0.0 110.684 173.336 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 38.9 p90 -151.46 165.68 33.44 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 124.09 0.956 . . . . 0.0 112.528 177.576 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -131.16 134.14 61.68 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 C-N-CA 125.612 1.565 . . . . 0.0 110.137 174.326 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 10.8 p -70.6 133.67 31.43 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 C-N-CA 123.723 0.809 . . . . 0.0 110.965 -176.164 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 5.1 t -85.24 120.26 73.18 Favored Pre-proline 0 C--O 1.238 0.493 0 C-N-CA 125.101 1.36 . . . . 0.0 110.321 173.824 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -76.5 146.25 27.29 Favored 'Trans proline' 0 C--N 1.352 0.713 0 C-N-CA 122.28 1.987 . . . . 0.0 111.146 169.583 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -62.92 -23.49 67.39 Favored 'General case' 0 N--CA 1.476 0.858 0 O-C-N 121.444 -0.785 . . . . 0.0 112.794 179.283 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 67.7 p -68.73 -18.23 64.2 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 125.49 1.516 . . . . 0.0 113.934 172.851 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 15.3 t -74.99 43.17 0.2 Allowed 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 124.881 1.272 . . . . 0.0 114.271 174.758 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 55.6 tt0 46.84 -99.13 0.04 OUTLIER 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 127.841 2.456 . . . . 0.0 114.226 170.121 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 79.7 m-20 -94.79 4.66 53.56 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 125.719 1.607 . . . . 0.0 114.712 -174.741 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 13.9 mtt 57.98 36.99 26.63 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 124.891 1.277 . . . . 0.0 114.083 -179.811 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -138.76 152.51 47.99 Favored 'General case' 0 CA--C 1.54 0.589 0 O-C-N 120.713 -1.242 . . . . 0.0 114.277 -176.584 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 17.6 t80 -151.06 174.15 13.52 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 126.139 1.776 . . . . 0.0 109.391 172.615 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 7.0 ttpm? -125.0 129.51 50.46 Favored 'General case' 0 N--CA 1.481 1.106 0 CA-C-N 120.702 1.592 . . . . 0.0 112.846 179.222 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 49.0 t -65.07 117.79 42.97 Favored Pre-proline 0 CA--C 1.538 0.482 0 C-N-CA 126.521 1.928 . . . . 0.0 111.032 172.778 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -63.96 -27.33 66.43 Favored 'Trans proline' 0 CA--C 1.54 0.791 0 C-N-CA 123.037 2.492 . . . . 0.0 115.114 176.437 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 97.0 mt -74.44 -55.18 12.83 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 124.174 0.989 . . . . 0.0 111.606 -172.492 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 15.3 p -100.74 -0.18 37.72 Favored 'General case' 0 CA--C 1.553 1.059 0 C-N-CA 124.287 1.035 . . . . 0.0 113.449 179.41 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 568' ' ' LYS . . . . . . . . . . . . . 1.6 mptp? 59.3 44.37 15.5 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 126.351 1.86 . . . . 0.0 112.041 -179.448 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 64.8 mm-40 -118.09 135.84 53.95 Favored 'General case' 0 N--CA 1.481 1.121 0 N-CA-C 114.312 1.227 . . . . 0.0 114.312 -173.954 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 94.0 m -76.13 116.11 16.51 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 123.427 0.691 . . . . 0.0 111.486 179.738 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 4.8 p -83.42 144.01 10.85 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.706 0 C-N-CA 124.49 1.116 . . . . 0.0 109.558 168.342 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 58.6 p -131.53 145.19 51.62 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 124.823 1.249 . . . . 0.0 110.692 178.82 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -68.7 138.01 31.21 Favored Glycine 0 CA--C 1.529 0.922 0 C-N-CA 124.327 0.965 . . . . 0.0 112.152 178.958 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 83.9 t -127.26 140.95 47.65 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.595 0 C-N-CA 124.583 1.153 . . . . 0.0 111.213 -176.586 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 65.9 t80 -64.91 124.2 21.42 Favored 'General case' 0 CA--C 1.545 0.784 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 -174.051 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 65.1 t0 -87.54 99.11 11.79 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 126.57 1.948 . . . . 0.0 109.803 172.269 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 -64.65 -24.45 67.59 Favored 'General case' 0 N--CA 1.473 0.712 0 N-CA-C 114.402 1.26 . . . . 0.0 114.402 -174.745 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 35.5 tp10 -75.34 -53.36 8.87 Favored 'General case' 0 N--CA 1.471 0.598 0 O-C-N 121.383 -0.823 . . . . 0.0 112.395 -179.187 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 65.2 m -87.74 -21.47 25.15 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 124.276 1.03 . . . . 0.0 113.189 179.5 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 79.91 30.35 43.42 Favored Glycine 0 CA--C 1.533 1.166 0 C-N-CA 124.712 1.149 . . . . 0.0 112.992 -175.382 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 79.2 mm-40 -111.33 -167.46 1.18 Allowed 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 125.861 1.664 . . . . 0.0 110.87 -177.5 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 73.3 m95 -125.41 145.89 49.86 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 125.399 1.48 . . . . 0.0 110.022 171.981 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 16.4 m -139.41 143.71 30.45 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.057 0 C-N-CA 124.838 1.255 . . . . 0.0 113.12 -172.135 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 12.3 m0 -94.35 102.05 14.03 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 126.036 1.735 . . . . 0.0 108.999 170.463 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 53.5 mtmt -74.14 151.13 40.13 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 125.828 1.651 . . . . 0.0 112.61 -177.275 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 54.3 t30 49.89 38.28 15.65 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 125.443 1.497 . . . . 0.0 112.825 -176.134 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 97.2 m -118.66 140.53 49.77 Favored 'General case' 0 N--CA 1.48 1.07 0 O-C-N 121.136 -0.978 . . . . 0.0 112.942 -172.212 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 14.0 tt -132.45 145.49 34.45 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.534 0 C-N-CA 127.729 2.412 . . . . 0.0 110.12 177.737 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 78.7 tt0 -108.86 131.99 54.46 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 124.861 1.264 . . . . 0.0 110.776 170.198 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 7.1 p -152.66 140.32 13.61 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 C-N-CA 124.786 1.235 . . . . 0.0 110.707 176.51 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 60.2 t30 53.4 37.68 26.1 Favored 'General case' 0 CA--C 1.553 1.084 0 C-N-CA 124.695 1.198 . . . . 0.0 113.21 179.268 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 73.35 10.2 78.49 Favored Glycine 0 CA--C 1.545 1.919 0 C-N-CA 124.828 1.204 . . . . 0.0 115.605 -179.678 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 55.4 mtmt -130.96 154.11 48.48 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 125.767 1.627 . . . . 0.0 111.979 -176.313 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 68.8 m-85 -92.91 149.56 21.17 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-O 121.949 0.88 . . . . 0.0 113.18 176.211 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -149.08 165.29 32.16 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 126.873 2.069 . . . . 0.0 109.489 -179.622 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 596' ' ' HIS . . . . . . . . . . . . . 26.1 m80 -83.52 141.49 31.59 Favored 'General case' 0 N--CA 1.467 0.388 0 O-C-N 121.68 -0.638 . . . . 0.0 109.58 168.424 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 15.3 m -64.93 -43.06 94.0 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 112.251 0.463 . . . . 0.0 112.251 -177.137 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 40.4 p -67.91 -41.75 82.19 Favored 'General case' 0 N--CA 1.481 1.104 0 N-CA-C 112.953 0.724 . . . . 0.0 112.953 175.769 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 599' ' ' CYS . . . . . . . . . . . . . 89.1 m -56.56 -54.37 46.69 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.489 1.116 . . . . 0.0 110.999 173.347 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 71.5 t80 -57.26 -45.06 84.36 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.166 0.987 . . . . 0.0 111.972 177.144 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 86.5 t60 -62.25 -42.53 99.4 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 114.071 1.137 . . . . 0.0 114.071 -179.194 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 75.1 mm-40 -80.21 -30.87 38.71 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 113.93 1.085 . . . . 0.0 113.93 177.186 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 86.6 m . . . . . 0 N--CA 1.484 1.253 0 N-CA-C 113.357 0.873 . . . . 0.0 113.357 -171.842 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 31.4 mm . . . . . 0 N--CA 1.47 0.56 0 CA-C-O 120.371 0.129 . . . . 0.0 111.022 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -69.93 -28.5 65.63 Favored 'General case' 0 N--CA 1.481 1.083 0 O-C-N 121.459 -0.775 . . . . 0.0 112.444 174.58 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -76.45 -9.08 86.08 Favored Glycine 0 CA--C 1.539 1.536 0 C-N-CA 125.435 1.493 . . . . 0.0 115.042 176.623 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 9.7 mmpt? -67.19 141.41 57.33 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-N 119.477 1.639 . . . . 0.0 111.14 172.349 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 51.5 p90 -153.79 164.83 37.68 Favored 'General case' 0 C--O 1.24 0.563 0 C-N-CA 124.354 1.062 . . . . 0.0 112.27 170.854 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 6.5 m -129.74 137.15 57.43 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 C-N-CA 126.19 1.796 . . . . 0.0 108.971 169.493 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 9.2 p -66.49 134.84 29.46 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.923 0 O-C-N 121.167 -0.958 . . . . 0.0 110.043 -179.312 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 3.3 t -88.09 114.55 59.82 Favored Pre-proline 0 CA--C 1.54 0.567 0 C-N-CA 123.68 0.792 . . . . 0.0 109.112 174.564 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 95.5 Cg_endo -74.29 162.97 37.45 Favored 'Trans proline' 0 CA--C 1.534 0.503 0 C-N-CA 122.704 2.269 . . . . 0.0 112.937 -178.826 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 17.1 pt-20 -66.0 -19.56 65.9 Favored 'General case' 0 N--CA 1.477 0.904 0 O-C-N 121.318 -0.864 . . . . 0.0 113.022 172.148 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 76.7 p -80.91 -6.07 58.22 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 126.057 1.743 . . . . 0.0 113.685 172.103 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 44.1 t -60.28 148.02 38.19 Favored 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 114.333 1.234 . . . . 0.0 114.333 -179.168 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 7.2 pt20 -74.32 88.05 2.03 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.953 1.301 . . . . 0.0 111.577 170.955 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 26.6 m-20 56.33 19.28 3.88 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 126.479 1.912 . . . . 0.0 115.175 176.313 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 10.5 mtt 55.75 30.98 16.63 Favored 'General case' 0 N--CA 1.472 0.625 0 N-CA-C 115.259 1.577 . . . . 0.0 115.259 -174.217 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -133.92 139.28 46.04 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.304 1.042 . . . . 0.0 112.637 -178.713 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 5.7 t80 -154.31 159.49 41.25 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 123.361 0.665 . . . . 0.0 112.107 177.74 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -88.88 152.44 21.74 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 125.465 1.506 . . . . 0.0 114.106 -172.74 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 25.3 t -104.16 104.41 43.76 Favored Pre-proline 0 CA--C 1.547 0.863 0 C-N-CA 126.615 1.966 . . . . 0.0 109.347 166.117 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -62.16 -23.49 75.53 Favored 'Trans proline' 0 CA--C 1.54 0.803 0 C-N-CA 123.243 2.629 . . . . 0.0 115.258 178.314 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 79.0 mt -72.96 -54.52 15.59 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 C-N-CA 124.089 0.956 . . . . 0.0 111.044 -176.749 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 14.1 p -102.8 1.19 33.84 Favored 'General case' 0 CA--C 1.551 1.014 0 N-CA-C 113.807 1.04 . . . . 0.0 113.807 -178.409 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 568' ' ' LYS . . . . . . . . . . . . 0.304 0.0 OUTLIER 55.73 43.71 27.45 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 127.808 2.443 . . . . 0.0 113.688 -175.909 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 70.9 mm-40 -110.88 -177.58 3.25 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.096 0.558 . . . . 0.0 112.41 179.568 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 99.1 m -125.9 126.72 44.87 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 124.817 1.247 . . . . 0.0 111.346 177.793 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 1.2 m -87.61 144.7 8.69 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.775 0 C-N-CA 124.645 1.178 . . . . 0.0 110.61 168.681 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 51.4 p -130.63 144.1 51.19 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 124.42 1.088 . . . . 0.0 111.296 176.438 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -67.54 152.81 52.8 Favored Glycine 0 CA--C 1.535 1.294 0 C-N-CA 124.201 0.905 . . . . 0.0 113.845 179.715 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 8.9 p -137.6 142.08 37.53 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 C-N-CA 125.177 1.391 . . . . 0.0 112.14 176.345 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 75.6 t80 -77.21 123.11 25.99 Favored 'General case' 0 CA--C 1.542 0.667 0 O-C-N 120.618 -1.301 . . . . 0.0 112.984 -173.214 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 24.3 t0 -90.08 118.14 29.39 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 124.67 1.188 . . . . 0.0 111.427 169.217 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 63.2 mt-10 -71.84 -27.75 63.1 Favored 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 113.656 0.984 . . . . 0.0 113.656 -178.788 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -75.31 -50.27 16.56 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 123.797 0.839 . . . . 0.0 111.998 -178.398 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 13.0 t -74.18 -28.98 61.54 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.461 0.705 . . . . 0.0 112.268 171.933 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 76.57 29.35 58.0 Favored Glycine 0 CA--C 1.536 1.39 0 C-N-CA 123.651 0.643 . . . . 0.0 112.721 -174.905 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 79.4 mm-40 -141.65 157.48 45.03 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 125.454 1.501 . . . . 0.0 111.106 -173.154 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 75.7 m95 -79.63 146.62 32.41 Favored 'General case' 0 N--CA 1.47 0.554 0 O-C-N 121.157 -0.964 . . . . 0.0 112.007 177.359 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 8.5 m -135.05 138.89 48.22 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 C-N-CA 126.249 1.82 . . . . 0.0 112.433 -177.068 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 0.8 OUTLIER -90.4 100.21 13.09 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 126.062 1.745 . . . . 0.0 107.23 170.229 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 42.7 mtmt -75.48 150.32 38.25 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 123.861 0.864 . . . . 0.0 112.367 179.088 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 54.1 t30 51.45 40.23 26.26 Favored 'General case' 0 CA--C 1.551 1.01 0 C-N-CA 125.627 1.571 . . . . 0.0 112.43 -174.666 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 80.6 m -125.21 145.88 49.77 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 124.149 0.98 . . . . 0.0 112.895 -174.584 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 8.4 tt -142.81 148.16 20.0 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 C-N-CA 127.577 2.351 . . . . 0.0 110.743 -178.825 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 60.4 tt0 -110.38 126.15 53.97 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 125.24 1.416 . . . . 0.0 109.539 169.683 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 2.2 t -142.99 129.57 17.61 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 C-N-CA 126.322 1.849 . . . . 0.0 109.809 -177.041 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 70.1 m-20 52.78 37.09 22.97 Favored 'General case' 0 CA--C 1.551 1.01 0 C-N-CA 125.064 1.346 . . . . 0.0 114.073 174.39 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 79.59 8.21 87.91 Favored Glycine 0 CA--C 1.536 1.397 0 C-N-CA 124.853 1.216 . . . . 0.0 115.485 -179.557 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 56.6 mtmt -127.54 155.46 43.76 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 125.878 1.671 . . . . 0.0 111.408 178.029 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 65.6 m-85 -98.87 149.45 22.9 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 123.905 0.882 . . . . 0.0 112.424 175.996 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 93.5 m-85 -150.58 162.04 41.42 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 126.087 1.755 . . . . 0.0 111.547 -174.924 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 596' ' ' HIS . . . . . 0.402 ' HB2' ' HB2' ' A' ' 599' ' ' CYS . 18.3 m80 -74.69 141.01 44.57 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 166.935 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 9.2 t -65.09 -40.36 94.49 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 118.219 0.463 . . . . 0.0 111.504 177.471 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 21.4 p -60.67 -45.32 94.59 Favored 'General case' 0 N--CA 1.478 0.938 0 N-CA-C 114.062 1.134 . . . . 0.0 114.062 172.001 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 599' ' ' CYS . . . . . 0.402 ' HB2' ' HB2' ' A' ' 596' ' ' HIS . 98.9 m -62.13 -51.52 67.56 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 123.884 0.874 . . . . 0.0 111.837 177.551 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 68.5 t80 -61.27 -41.97 97.85 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 123.599 0.759 . . . . 0.0 112.012 177.659 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 23.8 t-80 -68.01 -35.14 77.79 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 123.886 0.875 . . . . 0.0 113.263 178.238 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 31.8 tp10 -69.8 -34.21 73.41 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 124.514 1.125 . . . . 0.0 112.384 172.161 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 95.8 m . . . . . 0 N--CA 1.48 1.037 0 C-N-CA 124.122 0.969 . . . . 0.0 111.765 173.513 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 33.2 mm . . . . . 0 N--CA 1.477 0.881 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 547' ' ' ARG . . . . . 0.423 ' H ' ' HD2' ' A' ' 547' ' ' ARG . 0.0 OUTLIER -87.16 -8.99 56.36 Favored 'General case' 0 N--CA 1.48 1.038 0 N-CA-C 113.883 1.068 . . . . 0.0 113.883 177.988 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -77.69 -12.58 84.34 Favored Glycine 0 CA--C 1.537 1.447 0 C-N-CA 124.677 1.132 . . . . 0.0 114.523 170.301 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -69.75 135.33 49.62 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 118.769 1.284 . . . . 0.0 113.003 -178.462 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 42.7 p90 -154.74 162.82 40.97 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 124.737 1.215 . . . . 0.0 112.538 169.979 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -136.07 133.03 50.43 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.581 0 C-N-CA 126.246 1.819 . . . . 0.0 109.925 179.84 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 9.9 p -67.37 138.94 21.8 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.135 0 C-N-CA 123.633 0.773 . . . . 0.0 111.64 -175.868 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 61.6 t -76.24 115.74 49.77 Favored Pre-proline 0 N--CA 1.473 0.681 0 C-N-CA 124.53 1.132 . . . . 0.0 108.752 169.835 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -79.49 157.72 25.43 Favored 'Trans proline' 0 CA--C 1.54 0.791 0 C-N-CA 122.965 2.443 . . . . 0.0 111.972 176.914 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -64.63 -24.36 67.56 Favored 'General case' 0 CA--C 1.55 0.97 0 N-CA-C 113.414 0.894 . . . . 0.0 113.414 179.897 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 37.4 p -69.04 -37.36 78.55 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 125.557 1.543 . . . . 0.0 112.453 174.399 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 60.9 m -79.85 59.88 3.29 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.001 1.321 . . . . 0.0 111.046 171.267 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -65.7 -17.15 64.4 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 124.928 1.291 . . . . 0.0 114.131 -170.276 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 70.2 m-20 -73.85 -17.93 61.0 Favored 'General case' 0 N--CA 1.479 1.011 0 O-C-N 120.902 -1.124 . . . . 0.0 113.142 169.59 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 37.9 mtp 57.29 25.27 10.94 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 127.479 2.311 . . . . 0.0 115.102 176.886 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -140.96 152.82 45.28 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 124.319 1.048 . . . . 0.0 113.34 -175.073 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -156.1 160.66 40.14 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 126.45 1.9 . . . . 0.0 110.009 175.736 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 77.6 tttt -100.77 151.63 21.45 Favored 'General case' 0 N--CA 1.48 1.069 0 O-C-N 121.07 -1.019 . . . . 0.0 112.942 -179.455 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 49.0 t -92.22 110.27 43.33 Favored Pre-proline 0 CA--C 1.545 0.765 0 C-N-CA 127.374 2.27 . . . . 0.0 109.431 169.249 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -62.37 -15.37 44.63 Favored 'Trans proline' 0 CA--C 1.541 0.833 0 C-N-CA 123.919 3.08 . . . . 0.0 116.052 175.81 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 96.8 mt -80.05 -62.18 1.49 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.893 0 CA-C-N 119.311 0.959 . . . . 0.0 110.779 -179.239 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 14.7 p -96.96 -0.22 47.81 Favored 'General case' 0 CA--C 1.544 0.75 0 N-CA-C 113.947 1.092 . . . . 0.0 113.947 -177.521 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 568' ' ' LYS . . . . . . . . . . . . . 11.0 mptt 60.83 46.03 9.19 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 127.626 2.371 . . . . 0.0 111.707 -179.773 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 65.9 mm-40 -124.05 142.1 51.47 Favored 'General case' 0 N--CA 1.484 1.257 0 N-CA-C 114.947 1.462 . . . . 0.0 114.947 -175.085 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 88.4 m -87.71 122.41 31.35 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.794 0.838 . . . . 0.0 112.714 -177.42 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 2.9 m -81.98 151.13 4.27 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 C-N-CA 124.554 1.142 . . . . 0.0 110.007 167.243 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 57.6 p -131.96 147.97 52.49 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 124.728 1.211 . . . . 0.0 110.766 173.64 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -64.62 144.04 47.76 Favored Glycine 0 N--CA 1.468 0.825 0 C-N-CA 124.041 0.829 . . . . 0.0 113.775 -179.564 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 67.7 t -135.38 128.46 48.31 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.446 0 C-N-CA 125.575 1.55 . . . . 0.0 111.248 -179.52 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 88.3 t80 -67.59 115.72 7.5 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 121.687 -0.633 . . . . 0.0 112.278 -178.803 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -82.2 121.13 26.23 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 124.126 0.971 . . . . 0.0 110.234 169.888 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 53.0 mt-10 -70.72 -36.27 73.12 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.715 1.206 . . . . 0.0 113.841 -169.572 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -88.92 -33.93 17.1 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 119.041 0.837 . . . . 0.0 113.159 -178.586 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 19.3 m -72.24 -30.58 65.02 Favored 'General case' 0 N--CA 1.476 0.858 0 CA-C-N 118.421 0.555 . . . . 0.0 111.512 169.793 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 75.14 28.73 61.65 Favored Glycine 0 CA--C 1.535 1.289 0 C-N-CA 125.539 1.543 . . . . 0.0 113.562 -177.3 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 75.0 mm-40 -144.89 148.15 33.58 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 124.394 1.078 . . . . 0.0 112.246 -169.814 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 83.8 m95 -75.35 134.65 40.94 Favored 'General case' 0 C--N 1.327 -0.408 0 O-C-N 121.187 -0.946 . . . . 0.0 110.996 177.91 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 17.6 m -137.11 152.25 27.92 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 C-N-CA 126.359 1.864 . . . . 0.0 112.112 -173.704 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 5.8 m0 -93.96 102.64 14.74 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 126.011 1.724 . . . . 0.0 108.171 170.781 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 72.9 mmtt -78.12 145.44 35.73 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 124.408 1.083 . . . . 0.0 111.944 -178.431 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 60.08 37.64 20.93 Favored 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 125.097 1.359 . . . . 0.0 111.602 -175.691 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 26.8 m -128.7 149.02 50.86 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 124.783 1.233 . . . . 0.0 112.285 -171.222 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 17.3 tt -135.48 144.86 32.78 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 C-N-CA 127.507 2.323 . . . . 0.0 110.208 178.151 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 71.9 tt0 -106.15 125.63 51.23 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.478 1.111 . . . . 0.0 109.783 169.232 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 7.7 p -152.4 134.45 5.9 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.712 0 C-N-CA 124.589 1.155 . . . . 0.0 111.318 -175.826 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 70.9 m-20 53.27 35.29 19.73 Favored 'General case' 0 CA--C 1.553 1.093 0 C-N-CA 124.875 1.27 . . . . 0.0 114.266 -178.648 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 79.99 6.88 88.95 Favored Glycine 0 CA--C 1.538 1.529 0 C-N-CA 124.947 1.261 . . . . 0.0 115.64 179.727 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -130.43 158.39 40.03 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 125.388 1.475 . . . . 0.0 112.363 -179.383 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 78.3 m-85 -92.62 149.48 21.31 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-O 122.049 0.928 . . . . 0.0 113.02 176.222 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 77.2 m-85 -152.12 159.98 43.52 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 126.371 1.868 . . . . 0.0 109.746 -176.43 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 596' ' ' HIS . . . . . 0.426 ' HB2' ' HB2' ' A' ' 599' ' ' CYS . 28.8 m80 -76.76 140.2 40.69 Favored 'General case' 0 N--CA 1.473 0.694 0 O-C-N 120.915 -1.116 . . . . 0.0 108.369 167.82 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 53.1 p -63.76 -40.17 96.05 Favored 'General case' 0 N--CA 1.469 0.513 0 O-C-N 121.732 -0.605 . . . . 0.0 112.254 -177.74 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 7.2 p -69.39 -42.28 75.34 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 124.743 1.217 . . . . 0.0 113.157 174.844 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 599' ' ' CYS . . . . . 0.426 ' HB2' ' HB2' ' A' ' 596' ' ' HIS . 77.4 m -57.45 -54.95 41.05 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.304 1.042 . . . . 0.0 110.896 174.052 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 61.9 t80 -55.49 -49.01 73.66 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 124.09 0.956 . . . . 0.0 111.889 178.44 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 86.3 t60 -63.21 -40.32 97.15 Favored 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 113.114 0.783 . . . . 0.0 113.114 -178.795 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -71.45 -37.89 71.37 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 123.855 0.862 . . . . 0.0 112.657 176.83 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 91.6 m . . . . . 0 N--CA 1.476 0.857 0 C-N-CA 124.321 1.048 . . . . 0.0 113.549 -171.651 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 533' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.436 0 N-CA-C 111.551 -0.62 . . . . 0.0 111.551 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . -67.18 150.16 51.62 Favored Glycine 0 CA--C 1.537 1.408 0 CA-C-N 118.076 0.938 . . . . 0.0 113.416 175.799 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 535' ' ' SER . . . . . . . . . . . . . 61.0 p -70.16 -46.12 65.34 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 124.443 1.097 . . . . 0.0 112.332 178.825 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 536' ' ' GLU . . . . . . . . . . . . . 64.1 mt-10 -135.83 -21.88 1.45 Allowed 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 125.763 1.625 . . . . 0.0 113.56 175.84 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 537' ' ' PHE . . . . . . . . . . . . . 87.4 m-85 -70.82 142.7 51.27 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 124.023 0.929 . . . . 0.0 111.549 173.215 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 47.1 t -79.75 134.52 36.38 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 123.188 0.595 . . . . 0.0 111.594 171.026 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 539' ' ' ASP . . . . . . . . . . . . . 76.8 m-20 -87.71 0.25 55.97 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 124.659 1.183 . . . . 0.0 113.264 174.856 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 540' ' ' ARG . . . . . . . . . . . . . 76.8 mtp85 -77.98 31.17 0.17 Allowed 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 126.291 1.836 . . . . 0.0 114.646 -174.267 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 8.2 t 62.27 172.08 0.13 Allowed 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 127.766 2.426 . . . . 0.0 115.335 -177.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 542' ' ' ASN . . . . . . . . . . . . . 40.4 t30 -69.57 -12.63 61.8 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.754 1.622 . . . . 0.0 113.869 179.604 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 44.9 tp10 -54.58 -40.21 68.56 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 124.846 1.258 . . . . 0.0 113.106 -178.435 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 72.1 mt -77.46 -30.95 53.46 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 123.984 0.914 . . . . 0.0 112.866 176.752 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 37.9 tp10 -69.84 -30.48 67.98 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 124.313 1.045 . . . . 0.0 113.202 -174.808 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 18.0 mm -61.53 -43.01 96.18 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 123.552 0.741 . . . . 0.0 110.914 171.647 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 8.1 tmm_? -76.49 -23.83 53.79 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.919 1.288 . . . . 0.0 112.815 -177.243 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -71.45 -12.04 72.72 Favored Glycine 0 CA--C 1.541 1.689 0 C-N-CA 124.721 1.153 . . . . 0.0 115.579 175.941 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 71.8 mmtt -68.23 152.54 45.31 Favored 'General case' 0 N--CA 1.476 0.864 0 CA-C-N 119.108 1.454 . . . . 0.0 112.79 178.787 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 51.1 p90 -154.82 166.12 34.47 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 124.867 1.267 . . . . 0.0 112.629 172.796 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 1.6 m -135.35 140.2 45.32 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.885 0 C-N-CA 126.326 1.851 . . . . 0.0 110.294 175.767 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 78.8 t -69.07 130.9 34.22 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.232 0 O-C-N 121.297 -0.877 . . . . 0.0 111.278 -177.462 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 553' ' ' VAL . . . . . 0.458 HG22 ' CD2' ' A' ' 584' ' ' TRP . 11.2 t -79.26 122.44 84.16 Favored Pre-proline 0 CA--C 1.541 0.602 0 C-N-CA 124.183 0.993 . . . . 0.0 110.01 172.286 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -75.8 156.39 39.46 Favored 'Trans proline' 0 CA--C 1.537 0.663 0 C-N-CA 122.56 2.173 . . . . 0.0 112.251 176.484 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 15.7 pm0 -66.43 -17.25 64.68 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 124.295 1.038 . . . . 0.0 113.493 174.205 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 74.2 p -81.34 -9.28 59.78 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 125.891 1.677 . . . . 0.0 113.06 172.726 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 43.9 t -59.79 141.15 55.84 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 119.293 0.951 . . . . 0.0 113.225 179.451 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 88.3 mm-40 -75.11 97.13 3.38 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 124.115 0.966 . . . . 0.0 110.132 173.02 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 30.0 m-20 55.25 25.62 7.57 Favored 'General case' 0 CA--C 1.554 1.107 0 C-N-CA 126.288 1.835 . . . . 0.0 114.808 177.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 8.1 mtt 57.32 32.99 22.65 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 125.6 1.56 . . . . 0.0 114.707 179.391 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -137.8 149.4 46.34 Favored 'General case' 0 CA--C 1.538 0.489 0 N-CA-C 115.058 1.503 . . . . 0.0 115.058 -173.39 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 24.5 m-85 -149.25 165.68 31.19 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 127.34 2.256 . . . . 0.0 110.014 171.322 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 19.7 ttmm -117.95 133.9 55.47 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 123.928 0.891 . . . . 0.0 112.317 -179.092 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 14.4 t -73.59 111.73 13.26 Favored Pre-proline 0 CA--C 1.547 0.856 0 C-N-CA 127.045 2.138 . . . . 0.0 110.483 170.487 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 79.9 Cg_endo -70.64 -15.41 33.79 Favored 'Trans proline' 0 CA--C 1.542 0.913 0 C-N-CA 122.728 2.285 . . . . 0.0 114.132 175.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 93.0 mt -73.7 -56.12 10.33 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.823 0 C-N-CA 124.307 1.043 . . . . 0.0 110.924 -178.866 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 13.8 p -102.38 -1.68 30.36 Favored 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 124.752 1.221 . . . . 0.0 113.901 -179.816 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 568' ' ' LYS . . . . . . . . . . . . . 33.1 mmtp 62.65 41.67 9.08 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 127.072 2.149 . . . . 0.0 113.462 -178.173 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 75.0 mm-40 -122.76 145.62 48.25 Favored 'General case' 0 N--CA 1.482 1.175 0 N-CA-C 113.841 1.052 . . . . 0.0 113.841 -174.251 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 28.0 m -94.16 121.06 35.28 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.661 0.784 . . . . 0.0 111.463 -173.798 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 4.8 m -80.2 148.65 5.6 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.675 0 C-N-CA 124.62 1.168 . . . . 0.0 111.358 168.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 45.5 p -132.69 144.46 50.32 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 124.93 1.292 . . . . 0.0 111.193 174.843 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -67.31 152.17 52.59 Favored Glycine 0 CA--C 1.539 1.563 0 C-N-CA 124.419 1.009 . . . . 0.0 113.94 176.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 46.3 t -133.19 137.74 52.83 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.956 0 C-N-CA 125.937 1.695 . . . . 0.0 111.108 178.591 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 33.3 t80 -69.95 140.92 53.09 Favored 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 114.51 1.3 . . . . 0.0 114.51 -173.898 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 40.1 t0 -114.33 108.5 17.0 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 127.341 2.257 . . . . 0.0 110.469 170.858 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -66.23 -27.5 68.02 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 114.317 1.229 . . . . 0.0 114.317 -179.461 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -74.92 -50.76 15.73 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-N 118.994 0.815 . . . . 0.0 112.09 -176.79 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 25.3 t -77.52 -31.95 53.76 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 123.452 0.701 . . . . 0.0 111.704 174.255 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 81.92 29.53 38.07 Favored Glycine 0 CA--C 1.53 1.012 0 C-N-CA 124.011 0.815 . . . . 0.0 112.201 -173.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 80.0 mm-40 -129.61 -174.08 3.2 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 126.529 1.932 . . . . 0.0 110.156 -176.422 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 53.8 m95 -117.99 156.63 28.21 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.458 1.103 . . . . 0.0 110.986 178.815 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 17.7 m -137.62 140.36 41.57 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 C-N-CA 125.505 1.522 . . . . 0.0 112.816 -177.473 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 584' ' ' TRP . . . . . 0.458 ' CD2' HG22 ' A' ' 553' ' ' VAL . 1.1 m0 -90.95 105.6 17.94 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 126.575 1.95 . . . . 0.0 108.682 173.697 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 30.8 mmmt -72.27 142.52 48.91 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 125.144 1.378 . . . . 0.0 111.239 -177.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 57.9 t30 51.2 39.45 23.7 Favored 'General case' 0 CA--C 1.553 1.078 0 C-N-CA 125.633 1.573 . . . . 0.0 113.496 -177.247 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 89.7 m -124.01 149.63 45.8 Favored 'General case' 0 N--CA 1.482 1.129 0 O-C-N 120.629 -1.295 . . . . 0.0 112.966 -170.931 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 10.4 tt -141.51 137.27 32.4 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.636 0 C-N-CA 127.326 2.25 . . . . 0.0 110.638 178.909 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 77.5 tt0 -107.19 137.18 45.74 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 125.295 1.438 . . . . 0.0 109.664 169.715 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 7.6 p -151.71 123.29 1.06 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 C-N-CA 124.789 1.236 . . . . 0.0 110.847 179.084 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 35.3 m120 49.09 41.31 19.21 Favored 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 125.914 1.685 . . . . 0.0 114.11 174.433 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 85.97 1.41 86.85 Favored Glycine 0 CA--C 1.536 1.378 0 N-CA-C 116.071 1.189 . . . . 0.0 116.071 179.48 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -114.42 153.09 30.51 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 125.662 1.585 . . . . 0.0 111.984 177.469 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 42.0 m-85 -112.35 145.04 40.78 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 125.237 1.415 . . . . 0.0 111.937 177.8 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 99.1 m-85 -152.41 164.84 36.72 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 125.161 1.384 . . . . 0.0 111.541 -176.795 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 596' ' ' HIS . . . . . 0.426 ' HB2' ' HB2' ' A' ' 599' ' ' CYS . 21.4 m80 -78.15 144.51 36.35 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 166.501 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 19.5 t -64.16 -44.99 90.41 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 118.419 0.554 . . . . 0.0 111.365 178.29 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 22.8 p -64.09 -34.98 79.28 Favored 'General case' 0 N--CA 1.479 1.004 0 N-CA-C 114.016 1.117 . . . . 0.0 114.016 175.358 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 599' ' ' CYS . . . . . 0.426 ' HB2' ' HB2' ' A' ' 596' ' ' HIS . 87.9 m -71.53 -54.74 9.53 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 123.84 0.856 . . . . 0.0 111.22 176.226 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 70.7 t80 -61.04 -34.99 75.73 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 123.587 0.755 . . . . 0.0 112.606 -178.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 82.7 t60 -55.7 -31.88 62.83 Favored 'General case' 0 CA--C 1.543 0.688 0 O-C-N 121.167 -0.958 . . . . 0.0 113.554 176.394 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -73.27 -25.2 60.59 Favored 'General case' 0 CA--C 1.548 0.888 0 O-C-N 121.203 -0.935 . . . . 0.0 113.387 174.532 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 44.0 p -106.64 0.35 24.32 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 125.384 1.474 . . . . 0.0 114.429 -175.439 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 604' ' ' SER . . . . . . . . . . . . . 49.6 m -65.04 88.35 0.07 Allowed 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 125.503 1.521 . . . . 0.0 113.695 -179.83 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 605' ' ' GLN . . . . . . . . . . . . . 91.2 mt-30 -64.81 118.27 8.74 Favored 'General case' 0 CA--C 1.54 0.594 0 O-C-N 120.978 -1.077 . . . . 0.0 110.609 171.137 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 606' ' ' ASN . . . . . . . . . . . . . 5.2 p30 -154.25 148.84 26.34 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.325 1.05 . . . . 0.0 112.142 -177.376 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 607' ' ' SER . . . . . . . . . . . . . 72.2 p -165.31 -42.96 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 125.307 1.443 . . . . 0.0 112.039 174.204 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 608' ' ' SER . . . . . . . . . . . . . 51.6 p . . . . . 0 C--O 1.253 1.284 0 C-N-CA 126.447 1.899 . . . . 0.0 113.824 173.581 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 533' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.577 0 N-CA-C 111.896 -0.481 . . . . 0.0 111.896 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . -68.71 150.2 50.35 Favored Glycine 0 CA--C 1.537 1.424 0 C-N-CA 123.814 0.721 . . . . 0.0 113.631 178.882 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 535' ' ' SER . . . . . . . . . . . . . 78.4 p -70.65 -24.13 62.65 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.574 1.149 . . . . 0.0 113.683 178.878 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 536' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -141.28 94.07 2.65 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 125.953 1.701 . . . . 0.0 108.877 173.872 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 537' ' ' PHE . . . . . . . . . . . . . 52.7 t80 -153.91 -178.06 6.82 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 125.58 1.552 . . . . 0.0 111.423 -169.37 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 36.9 m -56.27 160.43 3.01 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 125.631 1.572 . . . . 0.0 113.688 174.25 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 539' ' ' ASP . . . . . . . . . . . . . 66.9 m-20 -73.03 69.58 1.0 Allowed 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 125.887 1.675 . . . . 0.0 113.825 -174.232 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 540' ' ' ARG . . . . . . . . . . . . . 27.7 mmm180 -73.08 63.04 0.66 Allowed 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 126.576 1.95 . . . . 0.0 112.349 175.148 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 43.8 t -64.39 152.4 41.5 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 125.46 1.504 . . . . 0.0 112.77 177.455 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 542' ' ' ASN . . . . . . . . . . . . . 77.6 m-20 -57.57 -26.36 61.35 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 124.016 0.926 . . . . 0.0 112.427 170.471 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 47.4 tp10 -54.97 -38.09 67.34 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 125.01 1.324 . . . . 0.0 111.892 173.432 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 37.2 mt -73.4 -36.39 66.0 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 123.501 0.72 . . . . 0.0 112.256 179.018 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -71.15 -33.53 70.13 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 123.864 0.865 . . . . 0.0 113.052 -179.049 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 12.0 mm -67.09 -35.83 75.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 122.963 0.505 . . . . 0.0 110.736 171.255 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 95.6 mtt-85 -77.84 -25.88 49.04 Favored 'General case' 0 N--CA 1.48 1.049 0 O-C-N 121.027 -1.046 . . . . 0.0 113.399 178.381 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -69.59 -9.01 61.08 Favored Glycine 0 CA--C 1.537 1.417 0 C-N-CA 125.537 1.541 . . . . 0.0 115.087 176.026 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -63.04 149.82 44.07 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-N 118.513 1.156 . . . . 0.0 111.714 170.744 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 45.6 p90 -156.44 166.61 32.93 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.205 1.002 . . . . 0.0 112.373 176.039 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 12.0 m -129.7 140.32 49.35 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 C-N-CA 126.299 1.84 . . . . 0.0 109.258 169.448 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 48.4 t -71.45 128.58 34.72 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.106 0 O-C-N 121.16 -0.963 . . . . 0.0 110.006 -177.225 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 553' ' ' VAL . . . . . 0.479 HG22 ' CD2' ' A' ' 584' ' ' TRP . 4.0 t -79.72 126.37 80.51 Favored Pre-proline 0 CA--C 1.538 0.498 0 C-N-CA 123.78 0.832 . . . . 0.0 109.001 171.169 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -66.82 145.15 73.9 Favored 'Trans proline' 0 CA--C 1.538 0.698 0 C-N-CA 122.734 2.289 . . . . 0.0 112.248 -177.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 17.1 pt-20 -63.14 -17.13 62.01 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 113.49 0.922 . . . . 0.0 113.49 175.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 10.7 m -66.08 -30.86 71.45 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 125.436 1.494 . . . . 0.0 112.002 171.729 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 28.7 t -81.01 130.84 35.2 Favored 'General case' 0 N--CA 1.472 0.643 0 O-C-N 121.632 -0.668 . . . . 0.0 111.684 174.062 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 2.6 pm0 -101.8 -25.8 13.69 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.692 1.597 . . . . 0.0 112.203 169.08 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 87.3 m-20 -77.41 -38.08 50.52 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 124.456 1.103 . . . . 0.0 112.924 179.781 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 8.7 mtt 51.46 36.01 15.69 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.694 1.597 . . . . 0.0 115.131 175.284 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -131.74 146.55 52.22 Favored 'General case' 0 CA--C 1.54 0.558 0 N-CA-C 114.057 1.132 . . . . 0.0 114.057 -173.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 2.8 t80 -153.98 179.66 8.7 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 125.749 1.62 . . . . 0.0 110.38 173.57 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 22.9 ttmm -135.05 138.16 43.62 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 124.434 1.094 . . . . 0.0 113.038 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 26.4 t -71.62 116.75 50.94 Favored Pre-proline 0 CA--C 1.539 0.544 0 C-N-CA 126.301 1.84 . . . . 0.0 110.198 170.271 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo -72.65 -17.68 26.04 Favored 'Trans proline' 0 CA--C 1.543 0.951 0 C-N-CA 122.859 2.373 . . . . 0.0 113.581 176.3 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 90.7 mt -73.02 -55.35 13.09 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 CA-C-N 119.803 1.183 . . . . 0.0 110.953 -178.547 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 14.9 p -103.35 2.76 34.44 Favored 'General case' 0 CA--C 1.553 1.062 0 C-N-CA 124.566 1.146 . . . . 0.0 113.494 -179.242 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 568' ' ' LYS . . . . . . . . . . . . 0.335 64.1 pttt 56.0 42.92 28.01 Favored 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 127.083 2.153 . . . . 0.0 113.608 -177.63 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 69.8 mm-40 -119.6 137.81 53.63 Favored 'General case' 0 N--CA 1.483 1.207 0 N-CA-C 114.803 1.409 . . . . 0.0 114.803 -174.666 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 49.9 m -74.37 140.55 44.86 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 124.679 1.192 . . . . 0.0 112.992 -178.214 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -114.84 145.51 20.5 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.617 0 C-N-CA 126.576 1.95 . . . . 0.0 110.86 168.948 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 44.6 p -133.31 141.53 48.01 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.601 1.16 . . . . 0.0 111.794 178.752 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -70.6 147.32 43.47 Favored Glycine 0 CA--C 1.534 1.236 0 C-N-CA 124.709 1.147 . . . . 0.0 113.615 -179.637 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 71.8 t -130.03 141.98 44.98 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 C-N-CA 125.318 1.447 . . . . 0.0 111.139 -179.737 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 62.0 t80 -65.41 131.33 46.16 Favored 'General case' 0 CA--C 1.544 0.742 0 CA-C-O 121.828 0.823 . . . . 0.0 112.725 -175.931 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 49.9 t0 -96.03 99.39 11.15 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 126.723 2.009 . . . . 0.0 111.391 174.061 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 69.0 mt-10 -66.34 -21.79 66.25 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 124.746 1.219 . . . . 0.0 113.958 179.776 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 36.7 tp10 -72.96 -34.66 66.64 Favored 'General case' 0 CA--C 1.542 0.645 0 O-C-N 120.499 -1.376 . . . . 0.0 113.103 -176.54 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 63.7 m -124.13 -13.13 7.33 Favored 'General case' 0 N--CA 1.474 0.749 0 N-CA-C 114.853 1.427 . . . . 0.0 114.853 -178.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 84.08 33.14 21.57 Favored Glycine 0 CA--C 1.531 1.055 0 C-N-CA 124.309 0.957 . . . . 0.0 113.209 176.209 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -121.83 -162.63 1.0 Allowed 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 125.14 1.376 . . . . 0.0 109.769 -178.488 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 62.8 m95 -129.18 155.08 46.09 Favored 'General case' 0 CA--C 1.533 0.302 0 O-C-N 121.116 -0.99 . . . . 0.0 111.465 175.431 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 16.2 m -139.37 134.03 39.54 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 C-N-CA 124.788 1.235 . . . . 0.0 112.933 -173.86 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 584' ' ' TRP . . . . . 0.479 ' CD2' HG22 ' A' ' 553' ' ' VAL . 1.0 OUTLIER -86.46 96.91 10.2 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 126.618 1.967 . . . . 0.0 108.331 169.748 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 67.3 mttm -74.34 149.75 40.44 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 124.674 1.19 . . . . 0.0 111.841 -179.838 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 64.79 0.62 1.2 Allowed 'General case' 0 CA--C 1.56 1.331 0 C-N-CA 126.805 2.042 . . . . 0.0 113.895 -172.269 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 54.0 m -94.91 149.05 21.66 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 125.622 1.569 . . . . 0.0 113.658 -171.186 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 14.4 tt -136.65 146.39 28.72 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.63 0 C-N-CA 127.834 2.454 . . . . 0.0 110.262 172.863 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 73.3 tt0 -108.3 126.87 53.33 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 124.632 1.173 . . . . 0.0 110.908 170.74 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 7.7 p -154.12 135.95 5.92 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 C-N-CA 124.951 1.3 . . . . 0.0 111.199 -177.441 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 71.9 m-20 52.54 38.28 25.27 Favored 'General case' 0 CA--C 1.552 1.057 0 C-N-CA 125.177 1.391 . . . . 0.0 113.666 -179.43 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 76.54 11.04 85.54 Favored Glycine 0 CA--C 1.535 1.305 0 C-N-CA 125.33 1.443 . . . . 0.0 115.62 178.438 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 56.8 mtmt -133.01 155.13 49.75 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 125.653 1.581 . . . . 0.0 111.907 -178.312 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 69.9 m-85 -92.48 147.2 23.09 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 124.271 1.028 . . . . 0.0 112.321 175.234 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 90.1 m-85 -152.21 171.12 18.43 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 126.554 1.942 . . . . 0.0 110.241 -174.432 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 596' ' ' HIS . . . . . . . . . . . . . 17.4 m80 -89.8 140.56 29.47 Favored 'General case' 0 N--CA 1.471 0.581 0 O-C-N 121.31 -0.869 . . . . 0.0 109.273 167.54 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 67.6 m -60.14 -41.72 93.31 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 123.391 0.676 . . . . 0.0 112.113 176.724 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 5.6 p -64.81 -42.73 94.77 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 124.977 1.311 . . . . 0.0 112.575 175.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 599' ' ' CYS . . . . . . . . . . . . . 90.8 m -65.57 -51.65 58.23 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 124.283 1.033 . . . . 0.0 111.108 177.147 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 83.7 t80 -57.84 -35.1 70.44 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 123.718 0.807 . . . . 0.0 112.608 178.064 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 1.7 m-70 -64.94 -21.63 66.86 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 114.352 1.241 . . . . 0.0 114.352 174.465 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 74.7 mt-10 -90.52 -34.15 15.66 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 119.369 0.986 . . . . 0.0 113.275 171.272 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 69.0 p -92.73 5.49 50.92 Favored 'General case' 0 N--CA 1.482 1.127 0 N-CA-C 114.542 1.312 . . . . 0.0 114.542 -175.057 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 604' ' ' SER . . . . . . . . . . . . . 98.0 p -62.85 -24.73 67.93 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 124.674 1.19 . . . . 0.0 113.97 -177.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 605' ' ' GLN . . . . . . . . . . . . . 77.9 mm-40 -98.87 134.32 41.9 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 125.257 1.423 . . . . 0.0 111.767 178.454 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 606' ' ' ASN . . . . . . . . . . . . . 52.3 t30 -76.33 162.66 27.72 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 123.724 0.81 . . . . 0.0 112.666 176.276 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 607' ' ' SER . . . . . . . . . . . . . 81.5 p -73.14 -12.89 61.05 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 114.709 1.374 . . . . 0.0 114.709 177.358 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 608' ' ' SER . . . . . . . . . . . . . 51.4 p . . . . . 0 C--O 1.254 1.306 0 C-N-CA 126.117 1.767 . . . . 0.0 113.993 178.254 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 533' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.508 0 N-CA-C 111.186 -0.766 . . . . 0.0 111.186 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . -77.03 -170.69 33.6 Favored Glycine 0 CA--C 1.538 1.476 0 C-N-CA 124.601 1.096 . . . . 0.0 114.416 175.538 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 535' ' ' SER . . . . . . . . . . . . . 43.3 t -62.78 140.06 58.73 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 124.055 0.942 . . . . 0.0 112.569 177.425 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 536' ' ' GLU . . . . . . . . . . . . . 4.0 pm0 -75.69 -18.42 59.62 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.261 1.025 . . . . 0.0 113.68 176.016 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 537' ' ' PHE . . . . . . . . . . . . . 47.7 t80 -157.73 -61.75 0.09 Allowed 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.993 0.917 . . . . 0.0 112.92 -178.869 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 59.6 p -157.81 172.13 19.05 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 124.747 1.219 . . . . 0.0 112.651 179.149 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 539' ' ' ASP . . . . . . . . . . . . . 41.0 p-10 -76.75 1.23 17.81 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 125.607 1.563 . . . . 0.0 114.731 177.074 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 540' ' ' ARG . . . . . . . . . . . . . 10.9 mpt_? -68.38 145.41 54.18 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 124.186 0.994 . . . . 0.0 112.729 179.1 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 89.4 p -148.63 9.92 0.82 Allowed 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 126.128 1.771 . . . . 0.0 112.46 173.791 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 542' ' ' ASN . . . . . . . . . . . . . 15.2 p-10 -115.39 -9.93 12.07 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 128.27 2.628 . . . . 0.0 113.201 -169.568 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 3.1 pm0 -62.05 -30.71 71.17 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 113.922 1.082 . . . . 0.0 113.922 -171.694 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 63.3 tp -69.66 -39.56 76.98 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.546 0.738 . . . . 0.0 111.793 174.517 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 58.1 mt-10 -83.22 -39.39 20.99 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 124.069 0.948 . . . . 0.0 113.279 -171.869 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 30.1 mm -65.14 -35.69 76.01 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.548 0 C-N-CA 123.359 0.664 . . . . 0.0 110.519 175.558 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -74.31 -22.41 59.28 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 124.216 1.007 . . . . 0.0 113.219 176.416 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -72.61 -13.58 77.9 Favored Glycine 0 CA--C 1.537 1.416 0 C-N-CA 124.709 1.147 . . . . 0.0 115.085 174.941 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -69.08 143.05 54.33 Favored 'General case' 0 N--CA 1.476 0.826 0 CA-C-N 118.272 1.036 . . . . 0.0 111.909 176.882 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 54.8 p90 -151.74 164.5 36.86 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 124.545 1.138 . . . . 0.0 112.634 173.718 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 10.6 m -130.48 139.99 49.94 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 C-N-CA 126.491 1.917 . . . . 0.0 109.07 169.613 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 9.2 p -72.29 136.95 24.54 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.048 0 O-C-N 120.871 -1.143 . . . . 0.0 111.151 -175.781 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 11.9 t -84.06 120.06 74.24 Favored Pre-proline 0 N--CA 1.469 0.519 0 C-N-CA 124.122 0.969 . . . . 0.0 108.534 171.264 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 90.6 Cg_endo -73.56 156.76 49.44 Favored 'Trans proline' 0 CA--C 1.539 0.745 0 C-N-CA 122.724 2.283 . . . . 0.0 112.278 177.782 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -61.26 -24.17 66.19 Favored 'General case' 0 N--CA 1.482 1.168 0 O-C-N 121.473 -0.767 . . . . 0.0 112.656 175.069 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 67.8 p -74.08 -19.91 60.45 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 125.433 1.493 . . . . 0.0 114.136 176.181 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 4.1 m -75.54 95.39 3.31 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 119.073 0.851 . . . . 0.0 110.4 172.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 29.0 mt-30 -58.0 -43.17 86.46 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 125.457 1.503 . . . . 0.0 114.022 -169.846 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 63.6 m-20 -94.99 -12.04 27.4 Favored 'General case' 0 CA--C 1.545 0.786 0 N-CA-C 114.185 1.18 . . . . 0.0 114.185 -176.412 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 7.8 mtt 51.4 31.19 6.95 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 126.135 1.774 . . . . 0.0 113.787 -170.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -128.08 148.78 50.58 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.294 1.437 . . . . 0.0 112.256 -178.076 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -150.99 171.84 16.65 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 125.256 1.422 . . . . 0.0 109.761 176.186 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 563' ' ' LYS . . . . . . . . . . . . 0.292 0.0 OUTLIER -117.84 156.84 27.68 Favored 'General case' 0 N--CA 1.479 0.979 0 N-CA-C 114.715 1.376 . . . . 0.0 114.715 178.795 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 23.9 t -98.3 109.09 50.9 Favored Pre-proline 0 CA--C 1.539 0.519 0 C-N-CA 127.897 2.479 . . . . 0.0 109.999 169.803 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -62.33 -19.63 67.73 Favored 'Trans proline' 0 C--N 1.352 0.724 0 C-N-CA 123.148 2.565 . . . . 0.0 115.206 174.503 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 90.1 mt -73.78 -61.51 1.67 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.908 0 CA-C-N 119.455 1.025 . . . . 0.0 110.74 -178.756 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 15.7 p -96.19 -0.39 50.02 Favored 'General case' 0 CA--C 1.548 0.888 0 N-CA-C 114.126 1.158 . . . . 0.0 114.126 -177.335 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 568' ' ' LYS . . . . . . . . . . . . . 47.0 mmtm 58.59 46.14 15.14 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 125.904 1.682 . . . . 0.0 112.053 -176.684 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 53.2 mm-40 -117.8 161.12 20.24 Favored 'General case' 0 N--CA 1.484 1.249 0 N-CA-C 113.783 1.031 . . . . 0.0 113.783 -177.057 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 58.4 m -102.82 127.58 49.94 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 124.012 0.925 . . . . 0.0 112.442 -179.134 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 3.1 m -91.46 149.29 4.14 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 C-N-CA 124.651 1.18 . . . . 0.0 110.556 167.901 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 43.8 p -132.45 142.06 49.09 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 125.111 1.364 . . . . 0.0 110.585 174.888 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -67.25 152.49 52.73 Favored Glycine 0 CA--C 1.528 0.891 0 C-N-CA 124.092 0.853 . . . . 0.0 113.489 179.195 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 57.4 t -133.65 133.1 57.23 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.858 0 C-N-CA 125.253 1.421 . . . . 0.0 111.629 176.822 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 44.8 t80 -70.12 128.18 35.39 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 114.052 1.13 . . . . 0.0 114.052 -173.051 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 13.4 t0 -98.02 114.05 26.09 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 125.365 1.466 . . . . 0.0 109.02 168.409 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 9.7 mp0 -72.83 -27.24 61.83 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 114.242 1.201 . . . . 0.0 114.242 -173.95 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -83.26 -44.38 15.02 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 123.904 0.881 . . . . 0.0 112.058 179.869 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 59.8 m -71.85 -30.22 65.22 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.21 0.604 . . . . 0.0 112.249 171.884 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 77.4 26.37 61.56 Favored Glycine 0 CA--C 1.534 1.227 0 C-N-CA 124.797 1.189 . . . . 0.0 112.978 -177.905 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 55.0 mt-10 -142.43 150.94 41.26 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 125.598 1.559 . . . . 0.0 110.434 -171.49 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 43.3 m95 -84.67 151.78 24.22 Favored 'General case' 0 CA--C 1.543 0.677 0 O-C-N 121.204 -0.935 . . . . 0.0 111.23 179.629 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 17.3 m -134.39 139.35 48.15 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.31 0 C-N-CA 125.227 1.411 . . . . 0.0 112.792 -176.482 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 2.6 m0 -89.64 100.8 13.53 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 126.399 1.88 . . . . 0.0 107.855 171.27 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 53.2 mtmt -78.76 157.96 28.37 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 124.395 1.078 . . . . 0.0 112.024 179.809 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 9.1 t30 54.58 30.7 13.64 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 125.265 1.426 . . . . 0.0 113.047 -174.227 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 86.1 m -122.52 148.12 45.55 Favored 'General case' 0 N--CA 1.48 1.036 0 O-C-N 121.0 -1.063 . . . . 0.0 112.15 -169.774 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 15.6 tt -138.25 142.35 35.61 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 C-N-CA 127.313 2.245 . . . . 0.0 110.973 178.664 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 77.8 tt0 -102.96 127.27 50.25 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.457 1.103 . . . . 0.0 110.224 169.388 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 7.6 p -152.67 133.24 4.28 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 C-N-CA 125.113 1.365 . . . . 0.0 110.819 -178.971 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 74.9 m-20 53.96 41.71 31.93 Favored 'General case' 0 CA--C 1.551 0.986 0 C-N-CA 124.801 1.24 . . . . 0.0 113.104 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 73.7 11.26 80.61 Favored Glycine 0 CA--C 1.536 1.396 0 C-N-CA 124.813 1.197 . . . . 0.0 115.551 179.141 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 36.3 mtmm -134.96 156.13 49.55 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 126.341 1.857 . . . . 0.0 111.849 -173.418 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 75.9 m-85 -100.03 146.13 27.1 Favored 'General case' 0 N--CA 1.464 0.25 0 C-N-CA 124.364 1.066 . . . . 0.0 113.282 179.412 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 86.5 m-85 -151.76 165.9 33.0 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 126.592 1.957 . . . . 0.0 110.366 -173.913 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 596' ' ' HIS . . . . . 0.424 ' HB2' ' HB2' ' A' ' 599' ' ' CYS . 20.7 m80 -81.09 142.97 32.78 Favored 'General case' 0 N--CA 1.468 0.44 0 O-C-N 121.381 -0.824 . . . . 0.0 109.491 168.77 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 66.9 p -60.88 -44.79 96.59 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 123.919 0.888 . . . . 0.0 111.681 176.942 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 18.7 p -63.99 -44.7 91.89 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 125.023 1.329 . . . . 0.0 112.93 175.322 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 599' ' ' CYS . . . . . 0.424 ' HB2' ' HB2' ' A' ' 596' ' ' HIS . 97.5 m -60.97 -45.47 94.63 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.587 1.155 . . . . 0.0 111.792 178.605 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 84.2 t80 -72.95 -32.17 65.07 Favored 'General case' 0 CA--C 1.546 0.804 0 N-CA-C 113.382 0.882 . . . . 0.0 113.382 177.556 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 57.4 t-80 -75.16 -81.67 0.07 Allowed 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 114.706 1.373 . . . . 0.0 114.706 -174.178 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -95.93 -6.96 37.89 Favored 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 113.616 0.969 . . . . 0.0 113.616 -174.253 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 1.5 m -91.81 -47.75 7.17 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.585 1.154 . . . . 0.0 111.996 -177.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 604' ' ' SER . . . . . . . . . . . . . 22.6 t -70.41 152.51 43.99 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 123.512 0.725 . . . . 0.0 111.233 171.736 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 605' ' ' GLN . . . . . . . . . . . . . 60.6 tt0 -64.8 123.1 18.5 Favored 'General case' 0 CA--C 1.541 0.621 0 O-C-N 121.409 -0.807 . . . . 0.0 110.673 177.472 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 606' ' ' ASN . . . . . . . . . . . . . 59.0 t30 -69.69 130.71 43.11 Favored 'General case' 0 CA--C 1.545 0.767 0 N-CA-C 113.242 0.83 . . . . 0.0 113.242 -169.894 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 607' ' ' SER . . . . . . . . . . . . . 42.0 m -78.66 163.98 25.0 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.997 1.319 . . . . 0.0 112.707 173.917 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 608' ' ' SER . . . . . . . . . . . . . 53.4 p . . . . . 0 C--O 1.252 1.234 0 C-N-CA 125.125 1.37 . . . . 0.0 113.309 170.821 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 533' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.545 0 N-CA-C 111.322 -0.711 . . . . 0.0 111.322 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . -82.4 -153.1 11.61 Favored Glycine 0 CA--C 1.537 1.453 0 C-N-CA 124.587 1.089 . . . . 0.0 113.586 176.106 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 535' ' ' SER . . . . . . . . . . . . . 77.8 p -67.37 -15.6 63.77 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 124.502 1.121 . . . . 0.0 113.488 172.212 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 536' ' ' GLU . . . . . . . . . . . . . 45.4 tt0 -138.85 125.13 20.29 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 126.565 1.946 . . . . 0.0 109.958 173.717 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 537' ' ' PHE . . . . . . . . . . . . . 38.6 p90 -158.45 172.53 18.16 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.188 1.395 . . . . 0.0 111.543 -178.761 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 16.8 t -149.3 159.76 43.99 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 125.164 1.385 . . . . 0.0 111.758 179.489 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 539' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -147.32 171.28 15.67 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 125.478 1.511 . . . . 0.0 112.045 -177.689 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 540' ' ' ARG . . . . . . . . . . . . . 77.3 mmt-85 -121.29 18.94 11.47 Favored 'General case' 0 N--CA 1.479 1.016 0 N-CA-C 114.542 1.312 . . . . 0.0 114.542 -171.088 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 44.2 t -62.2 119.39 8.91 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 121.635 -0.666 . . . . 0.0 110.94 175.019 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 542' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -78.13 -19.8 53.37 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 123.386 0.674 . . . . 0.0 111.769 176.648 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -63.18 -28.96 70.41 Favored 'General case' 0 CA--C 1.54 0.558 0 N-CA-C 113.465 0.913 . . . . 0.0 113.465 -170.615 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -65.03 -40.89 95.5 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.003 0.921 . . . . 0.0 111.488 174.197 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 75.7 mm-40 -76.07 -30.55 58.4 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.76 0.824 . . . . 0.0 112.661 178.101 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 11.2 mm -66.34 -40.97 88.08 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.599 0 C-N-CA 123.991 0.916 . . . . 0.0 110.297 169.083 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 79.7 ttt180 -65.94 -28.92 69.28 Favored 'General case' 0 N--CA 1.478 0.927 0 O-C-N 121.125 -0.984 . . . . 0.0 112.173 -179.202 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -71.96 -7.55 66.65 Favored Glycine 0 CA--C 1.542 1.734 0 C-N-CA 124.706 1.146 . . . . 0.0 115.428 175.061 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 41.8 mmtm -70.3 144.66 51.67 Favored 'General case' 0 N--CA 1.479 0.996 0 CA-C-N 119.771 1.786 . . . . 0.0 111.227 177.858 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 40.2 p90 -149.29 166.47 28.86 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 113.937 1.088 . . . . 0.0 113.937 178.198 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 4.8 m -136.74 138.84 45.8 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.841 0 C-N-CA 126.801 2.04 . . . . 0.0 109.73 174.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 44.0 t -70.29 133.98 30.88 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 O-C-N 121.084 -1.01 . . . . 0.0 110.998 -177.972 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 3.1 t -91.88 124.31 60.63 Favored Pre-proline 0 N--CA 1.471 0.591 0 C-N-CA 124.273 1.029 . . . . 0.0 111.639 178.198 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 62.1 Cg_endo -80.48 152.46 20.32 Favored 'Trans proline' 0 CA--C 1.538 0.714 0 C-N-CA 123.274 2.649 . . . . 0.0 111.638 169.893 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -66.77 -18.32 65.31 Favored 'General case' 0 CA--C 1.548 0.88 0 O-C-N 120.401 -1.437 . . . . 0.0 113.103 175.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -71.73 -22.65 61.6 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 124.877 1.271 . . . . 0.0 113.44 173.204 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 9.6 m -73.51 121.63 20.9 Favored 'General case' 0 N--CA 1.473 0.702 0 O-C-N 121.497 -0.752 . . . . 0.0 110.328 170.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 55.2 tp60 -53.41 116.09 2.26 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 125.077 1.351 . . . . 0.0 112.484 -168.514 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 53.31 20.95 2.1 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 126.559 1.944 . . . . 0.0 114.822 177.789 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 28.6 mtt 53.47 33.08 15.27 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 125.522 1.529 . . . . 0.0 113.443 -168.834 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -126.95 134.65 50.36 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 125.031 1.332 . . . . 0.0 112.544 -177.053 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 41.6 t80 -148.21 161.33 41.69 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 124.861 1.264 . . . . 0.0 110.041 174.948 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 3.5 ttmp? -112.67 131.26 55.73 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 123.827 0.851 . . . . 0.0 113.001 -171.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 22.6 t -68.11 111.77 8.8 Favored Pre-proline 0 CA--C 1.541 0.633 0 C-N-CA 126.064 1.745 . . . . 0.0 109.479 168.644 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -69.83 -17.34 37.32 Favored 'Trans proline' 0 CA--C 1.54 0.815 0 C-N-CA 122.515 2.143 . . . . 0.0 113.349 177.691 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 86.8 mt -70.28 -51.54 37.63 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.672 0 C-N-CA 124.593 1.157 . . . . 0.0 110.898 -177.706 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 14.6 p -110.75 -0.86 16.89 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 124.729 1.212 . . . . 0.0 114.071 -178.877 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 568' ' ' LYS . . . . . . . . . . . . . 34.1 mmtp 60.64 45.86 9.88 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 126.604 1.962 . . . . 0.0 113.352 -177.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 74.7 mt-10 -120.79 138.67 53.91 Favored 'General case' 0 N--CA 1.481 1.078 0 N-CA-C 113.746 1.017 . . . . 0.0 113.746 -175.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 97.1 m -83.77 121.48 27.36 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.256 0.622 . . . . 0.0 112.181 -179.234 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 1.7 m -88.11 143.65 10.82 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 C-N-CA 125.22 1.408 . . . . 0.0 110.364 168.172 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 69.1 p -124.62 142.77 51.13 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 124.971 1.309 . . . . 0.0 111.629 -179.187 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -74.97 145.55 33.8 Favored Glycine 0 CA--C 1.53 0.988 0 C-N-CA 124.302 0.953 . . . . 0.0 113.372 179.065 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 61.6 t -135.32 141.6 42.11 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.875 0 C-N-CA 125.599 1.56 . . . . 0.0 111.554 -177.336 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 62.1 t80 -70.52 127.39 32.55 Favored 'General case' 0 CA--C 1.542 0.64 0 O-C-N 121.277 -0.889 . . . . 0.0 112.976 -176.697 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 65.1 t0 -94.12 104.21 16.24 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 127.072 2.149 . . . . 0.0 109.892 170.015 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -66.89 -26.97 67.14 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.072 1.349 . . . . 0.0 114.45 -177.624 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 31.8 tp10 -78.66 -44.31 24.04 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 123.609 0.763 . . . . 0.0 111.713 -178.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 22.8 t -81.57 -35.32 30.37 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 124.903 1.281 . . . . 0.0 112.276 177.219 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 84.17 32.81 22.18 Favored Glycine 0 CA--C 1.53 1.031 0 C-N-CA 124.513 1.054 . . . . 0.0 113.468 -172.736 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 81.8 mm-40 -130.16 178.54 6.48 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.479 1.512 . . . . 0.0 110.705 -175.537 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 68.6 m95 -111.25 145.4 38.82 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 121.015 -1.053 . . . . 0.0 110.251 171.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 13.8 m -137.72 138.04 44.68 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.892 0 C-N-CA 124.985 1.314 . . . . 0.0 113.227 -172.057 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 0.8 OUTLIER -87.26 100.95 13.07 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 126.327 1.851 . . . . 0.0 107.228 169.952 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 56.7 mtmt -73.56 157.03 37.46 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 124.184 0.993 . . . . 0.0 111.253 177.093 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 55.2 33.4 20.48 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 125.307 1.443 . . . . 0.0 112.392 -176.407 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 55.2 m -130.36 147.78 52.1 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 124.71 1.204 . . . . 0.0 112.239 -169.432 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 14.7 tt -136.41 144.16 33.61 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.718 0 C-N-CA 126.978 2.111 . . . . 0.0 111.096 178.543 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -105.89 135.79 46.7 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 125.243 1.417 . . . . 0.0 110.157 168.722 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 7.5 p -147.66 123.51 2.64 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.619 0 C-N-CA 124.289 1.036 . . . . 0.0 111.006 173.88 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 69.9 m-20 51.08 36.58 15.78 Favored 'General case' 0 CA--C 1.551 1.003 0 C-N-CA 125.472 1.509 . . . . 0.0 114.245 175.402 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 89.15 -9.19 77.82 Favored Glycine 0 CA--C 1.536 1.405 0 C-N-CA 125.32 1.438 . . . . 0.0 115.633 -179.221 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 63.4 mttp -95.87 153.77 17.58 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 125.578 1.551 . . . . 0.0 111.78 176.329 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 69.1 m-85 -113.38 142.75 45.5 Favored 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 125.0 1.32 . . . . 0.0 112.259 174.485 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 16.3 m-85 -149.18 159.01 44.63 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 126.307 1.843 . . . . 0.0 110.6 -173.569 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 596' ' ' HIS . . . . . . . . . . . . . 11.8 m80 -71.31 139.13 49.81 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 106.539 -1.652 . . . . 0.0 106.539 165.555 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 72.8 p -59.3 -43.0 92.65 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 122.995 0.518 . . . . 0.0 111.935 178.603 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 14.1 p -71.59 -33.41 69.01 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 125.362 1.465 . . . . 0.0 113.693 178.144 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 599' ' ' CYS . . . . . . . . . . . . . 99.3 m -66.68 -52.46 44.57 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.657 0.783 . . . . 0.0 111.021 172.495 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 66.1 t80 -57.53 -40.67 79.32 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 123.183 0.593 . . . . 0.0 111.955 176.73 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 69.8 t60 -56.36 -46.84 79.82 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.837 1.255 . . . . 0.0 113.872 175.384 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -77.76 -23.75 49.15 Favored 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 114.044 1.127 . . . . 0.0 114.044 174.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 68.4 m -77.38 -29.21 53.14 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 124.939 1.296 . . . . 0.0 112.714 179.227 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 604' ' ' SER . . . . . . . . . . . . . 33.4 t -56.48 112.1 1.17 Allowed 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.817 1.247 . . . . 0.0 112.809 -174.664 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 605' ' ' GLN . . . . . . . . . . . . . 43.1 tp60 -160.3 -39.39 0.05 Allowed 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 126.475 1.91 . . . . 0.0 111.571 -176.347 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 606' ' ' ASN . . . . . . . . . . . . . 14.8 p-10 -72.13 -9.07 57.92 Favored 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 125.995 1.718 . . . . 0.0 114.404 174.62 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 607' ' ' SER . . . . . . . . . . . . . 20.4 m -62.97 141.98 58.53 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 125.541 1.536 . . . . 0.0 113.29 -175.649 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 608' ' ' SER . . . . . . . . . . . . . 39.2 m . . . . . 0 C--O 1.253 1.269 0 C-N-CA 125.578 1.551 . . . . 0.0 114.05 179.066 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 533' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.71 0 N-CA-C 111.866 -0.494 . . . . 0.0 111.866 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 72.35 22.69 78.79 Favored Glycine 0 CA--C 1.538 1.489 0 O-C-N 121.76 -0.847 . . . . 0.0 115.197 177.385 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 535' ' ' SER . . . . . . . . . . . . . 71.4 p -68.68 -15.25 63.46 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 124.949 1.299 . . . . 0.0 114.438 -178.474 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 536' ' ' GLU . . . . . . . . . . . . . 11.9 tp10 -141.5 110.24 6.11 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 125.655 1.582 . . . . 0.0 108.928 171.635 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 537' ' ' PHE . . . . . . . . . . . . . 42.6 p90 -73.66 -20.69 60.49 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 115.294 1.59 . . . . 0.0 115.294 -169.238 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 69.1 m -110.54 -4.2 15.6 Favored 'General case' 0 N--CA 1.48 1.058 0 N-CA-C 114.667 1.358 . . . . 0.0 114.667 179.4 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 539' ' ' ASP . . . . . . . . . . . . . 12.0 t0 56.82 -165.75 0.14 Allowed 'General case' 0 CA--C 1.559 1.325 0 C-N-CA 124.65 1.18 . . . . 0.0 111.342 -168.245 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 540' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.81 -16.84 63.62 Favored 'General case' 0 N--CA 1.484 1.238 0 O-C-N 119.931 -1.731 . . . . 0.0 114.183 174.782 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 20.3 m -65.62 130.84 44.71 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 125.535 1.534 . . . . 0.0 111.793 -179.035 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 542' ' ' ASN . . . . . . . . . . . . . 45.9 m-80 -140.64 120.28 13.33 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 125.212 1.405 . . . . 0.0 110.639 -179.655 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 16.8 pt-20 -152.3 -29.61 0.16 Allowed 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 124.475 1.11 . . . . 0.0 113.927 179.596 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 86.7 mt -67.64 -30.88 70.56 Favored 'General case' 0 N--CA 1.472 0.671 0 O-C-N 121.48 -0.762 . . . . 0.0 112.468 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 18.0 tp10 -64.56 -30.49 71.51 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.524 1.13 . . . . 0.0 112.49 176.589 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 18.5 mm -62.78 -34.77 67.59 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 124.952 1.301 . . . . 0.0 111.454 -178.567 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 45.0 ttt180 -61.34 -21.66 64.21 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.518 1.127 . . . . 0.0 112.879 179.442 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -71.79 -11.67 73.75 Favored Glycine 0 CA--C 1.539 1.569 0 C-N-CA 124.643 1.116 . . . . 0.0 115.251 176.03 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -69.76 146.32 51.55 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-N 119.201 1.501 . . . . 0.0 112.18 173.417 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 47.6 p90 -156.5 166.52 33.18 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 124.955 1.302 . . . . 0.0 111.772 171.59 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 2.5 m -128.93 133.5 66.0 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 C-N-CA 124.618 1.167 . . . . 0.0 109.745 170.479 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 53.3 t -68.23 132.41 32.78 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 O-C-N 121.26 -0.9 . . . . 0.0 110.113 -179.796 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 22.4 t -78.97 119.08 75.94 Favored Pre-proline 0 N--CA 1.472 0.651 0 CA-C-O 118.483 -0.77 . . . . 0.0 110.588 -179.239 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 65.3 Cg_endo -78.82 156.24 27.24 Favored 'Trans proline' 0 CA--C 1.537 0.643 0 C-N-CA 123.126 2.551 . . . . 0.0 112.15 176.84 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -67.47 -17.81 64.83 Favored 'General case' 0 N--CA 1.474 0.738 0 O-C-N 121.486 -0.759 . . . . 0.0 112.884 176.885 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 66.8 p -74.06 -22.99 59.31 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 125.02 1.328 . . . . 0.0 113.493 173.913 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 24.7 m -80.2 112.09 17.18 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 123.997 0.919 . . . . 0.0 111.683 175.258 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -62.08 136.22 57.85 Favored 'General case' 0 CA--C 1.546 0.824 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 -173.667 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 33.8 m-20 53.92 15.32 0.83 Allowed 'General case' 0 CA--C 1.553 1.073 0 C-N-CA 126.733 2.013 . . . . 0.0 115.418 176.918 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 18.9 mtt 51.35 31.93 7.78 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 125.672 1.589 . . . . 0.0 114.659 -171.494 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -123.95 142.67 50.95 Favored 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 113.851 1.056 . . . . 0.0 113.851 -174.526 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 6.5 t80 -153.91 -179.97 8.35 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 125.919 1.688 . . . . 0.0 109.963 173.378 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 18.1 ttmm -130.56 152.91 49.42 Favored 'General case' 0 N--CA 1.48 1.032 0 O-C-N 120.628 -1.295 . . . . 0.0 113.385 -175.273 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 19.2 t -95.9 107.0 31.5 Favored Pre-proline 0 CA--C 1.543 0.71 0 C-N-CA 127.865 2.466 . . . . 0.0 110.307 170.865 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_exo -62.38 -20.45 70.37 Favored 'Trans proline' 0 CA--C 1.546 1.086 0 C-N-CA 122.268 1.979 . . . . 0.0 115.736 174.71 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 88.7 mt -69.38 -52.26 34.51 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 C-N-CA 124.266 1.026 . . . . 0.0 111.35 -177.205 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 14.9 p -108.62 -0.71 20.06 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 124.328 1.051 . . . . 0.0 113.717 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 568' ' ' LYS . . . . . . . . . . . . . 95.1 mttt 59.82 44.43 13.88 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 126.966 2.106 . . . . 0.0 113.151 -177.571 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 64.8 mt-10 -112.0 138.93 47.97 Favored 'General case' 0 N--CA 1.479 0.995 0 N-CA-C 113.488 0.922 . . . . 0.0 113.488 -177.697 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 57.7 m -85.71 121.24 28.1 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 123.216 0.606 . . . . 0.0 111.037 177.778 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 3.8 m -88.4 144.15 9.76 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 C-N-CA 125.442 1.497 . . . . 0.0 110.502 170.414 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 74.6 p -128.94 144.81 51.29 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.976 1.311 . . . . 0.0 110.799 174.274 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -72.03 141.06 30.95 Favored Glycine 0 CA--C 1.525 0.677 0 C-N-CA 124.152 0.882 . . . . 0.0 112.547 -178.138 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 33.3 m -132.63 139.72 49.18 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 C-N-CA 124.497 1.119 . . . . 0.0 112.001 -178.545 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 79.2 t80 -75.32 113.69 12.99 Favored 'General case' 0 CA--C 1.54 0.589 0 O-C-N 121.4 -0.813 . . . . 0.0 111.284 179.581 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -82.3 118.21 22.97 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.371 1.068 . . . . 0.0 110.447 170.67 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 11.6 mp0 -73.87 -28.11 61.41 Favored 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 114.017 1.117 . . . . 0.0 114.017 -173.335 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 32.8 tp10 -81.52 -41.92 20.97 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.228 1.011 . . . . 0.0 111.914 -179.41 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 36.0 t -74.62 -35.88 62.93 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 125.016 1.326 . . . . 0.0 112.015 173.072 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 80.91 33.1 30.79 Favored Glycine 0 CA--C 1.534 1.246 0 C-N-CA 124.491 1.043 . . . . 0.0 113.053 -177.042 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 69.9 mm-40 -144.93 149.95 36.15 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 125.138 1.375 . . . . 0.0 111.716 -171.518 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 84.5 m95 -76.89 134.5 38.96 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 122.723 0.409 . . . . 0.0 110.555 170.032 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 8.1 m -139.41 145.05 27.71 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 C-N-CA 124.658 1.183 . . . . 0.0 113.007 -168.765 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 2.8 m0 -93.81 97.6 10.52 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 106.715 -1.587 . . . . 0.0 106.715 167.623 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 61.6 mttm -74.32 145.07 44.21 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 124.447 1.099 . . . . 0.0 111.959 -175.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 62.9 t30 52.16 37.12 20.91 Favored 'General case' 0 CA--C 1.551 0.994 0 C-N-CA 126.33 1.852 . . . . 0.0 113.201 -170.588 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 88.4 m -119.18 147.13 44.55 Favored 'General case' 0 N--CA 1.481 1.108 0 O-C-N 120.67 -1.269 . . . . 0.0 112.252 -176.148 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 13.2 tt -136.66 145.65 29.94 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.64 0 C-N-CA 127.888 2.475 . . . . 0.0 110.719 -178.9 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 73.5 tt0 -105.7 125.68 51.27 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.569 1.148 . . . . 0.0 110.564 169.793 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 8.3 p -158.93 145.84 7.5 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 C-N-CA 124.997 1.319 . . . . 0.0 110.655 179.876 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 53.9 t30 53.01 38.73 28.04 Favored 'General case' 0 CA--C 1.554 1.111 0 C-N-CA 124.431 1.092 . . . . 0.0 112.55 -177.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 65.95 14.89 61.81 Favored Glycine 0 CA--C 1.534 1.257 0 C-N-CA 125.51 1.529 . . . . 0.0 115.971 -179.844 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 35.8 mtmm -134.83 159.95 39.76 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 126.349 1.86 . . . . 0.0 110.938 -177.278 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 70.4 m-85 -91.03 149.7 21.73 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-O 121.979 0.895 . . . . 0.0 112.08 169.866 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 9.8 m-85 -145.9 165.31 29.31 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 127.283 2.233 . . . . 0.0 109.387 177.576 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 596' ' ' HIS . . . . . . . . . . . . . 26.7 m80 -77.94 141.88 38.73 Favored 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 108.161 -1.052 . . . . 0.0 108.161 166.102 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 8.4 t -65.94 -41.73 90.94 Favored 'General case' 0 N--CA 1.466 0.353 0 O-C-N 121.805 -0.559 . . . . 0.0 112.018 -177.186 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 22.3 p -64.72 -42.64 95.09 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 123.608 0.763 . . . . 0.0 112.683 173.666 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 599' ' ' CYS . . . . . . . . . . . . . 64.2 m -56.14 -58.27 8.66 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.589 1.155 . . . . 0.0 110.824 174.617 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 76.5 t80 -58.69 -46.77 86.51 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.414 0.686 . . . . 0.0 112.456 179.793 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 33.9 t-80 -58.73 -47.21 85.39 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 124.102 0.961 . . . . 0.0 113.129 -176.662 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 35.5 tp10 -77.29 -30.5 54.23 Favored 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 112.72 0.637 . . . . 0.0 112.72 -179.902 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 98.6 m -81.21 -34.03 32.52 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.761 0.825 . . . . 0.0 112.981 -176.787 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 604' ' ' SER . . . . . . . . . . . . . 38.0 t -64.06 129.93 41.97 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 124.254 1.022 . . . . 0.0 112.915 -174.068 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 605' ' ' GLN . . . . . . . . . . . . . 14.4 tt0 -115.48 135.78 53.75 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.869 1.668 . . . . 0.0 109.867 172.804 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 606' ' ' ASN . . . . . . . . . . . . . 56.3 m-80 -139.13 154.52 48.12 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.153 1.381 . . . . 0.0 111.837 -171.481 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 607' ' ' SER . . . . . . . . . . . . . 17.4 t -71.39 151.29 44.2 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.609 1.164 . . . . 0.0 112.479 178.788 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 608' ' ' SER . . . . . . . . . . . . . 46.1 m . . . . . 0 C--O 1.255 1.37 0 C-N-CA 126.062 1.745 . . . . 0.0 113.816 -177.209 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 533' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.371 0 N-CA-C 111.088 -0.805 . . . . 0.0 111.088 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 104.38 17.14 16.2 Favored Glycine 0 CA--C 1.538 1.529 0 C-N-CA 125.354 1.454 . . . . 0.0 115.574 178.746 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 535' ' ' SER . . . . . . . . . . . . . 23.4 t -139.18 -15.32 1.12 Allowed 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 125.042 1.337 . . . . 0.0 113.722 -178.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 536' ' ' GLU . . . . . . . . . . . . . 18.9 mp0 -68.84 6.06 0.97 Allowed 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 127.164 2.186 . . . . 0.0 115.953 -170.918 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 537' ' ' PHE . . . . . . . . . . . . . 47.6 p90 -67.32 -18.14 65.05 Favored 'General case' 0 CA--C 1.546 0.802 0 O-C-N 120.527 -1.358 . . . . 0.0 112.77 169.531 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 96.7 p -150.76 157.27 42.74 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 126.192 1.797 . . . . 0.0 110.596 169.519 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 539' ' ' ASP . . . . . . . . . . . . . 30.8 m-20 -142.53 154.35 44.41 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 124.555 1.142 . . . . 0.0 112.958 -175.974 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 540' ' ' ARG . . . . . . . . . . . . . 30.8 mmt180 -89.13 22.95 2.59 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 125.605 1.562 . . . . 0.0 112.424 170.659 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 92.9 p -74.96 175.56 8.0 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 126.351 1.86 . . . . 0.0 113.279 -172.55 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 542' ' ' ASN . . . . . . . . . . . . . 29.1 m120 -63.35 -11.42 22.32 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 114.039 1.126 . . . . 0.0 114.039 178.731 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 22.0 tp10 -52.78 -53.21 51.42 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-N 119.993 1.269 . . . . 0.0 111.977 178.711 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 85.7 mt -65.49 -33.14 75.25 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 123.5 0.72 . . . . 0.0 112.438 179.404 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -73.78 -41.63 62.14 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 124.092 0.957 . . . . 0.0 112.651 -177.321 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 33.9 mm -71.46 -31.61 43.52 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.658 0 C-N-CA 124.342 1.057 . . . . 0.0 110.847 173.451 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 19.0 tpp180 -68.14 -34.62 76.7 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 124.333 1.053 . . . . 0.0 111.767 175.896 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -72.61 -6.14 65.73 Favored Glycine 0 CA--C 1.537 1.424 0 C-N-CA 125.76 1.648 . . . . 0.0 115.645 177.176 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 73.4 mmtt -76.67 125.84 29.94 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-N 119.576 1.688 . . . . 0.0 110.289 171.897 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 39.5 p90 -149.29 162.89 39.15 Favored 'General case' 0 C--O 1.237 0.404 0 N-CA-C 113.277 0.843 . . . . 0.0 113.277 176.619 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -135.68 138.13 48.37 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.485 0 C-N-CA 126.274 1.83 . . . . 0.0 110.422 179.044 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 76.2 t -70.54 134.92 29.18 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.939 0 C-N-CA 123.821 0.849 . . . . 0.0 110.812 -175.61 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 72.7 t -64.96 121.79 75.87 Favored Pre-proline 0 CA--C 1.544 0.719 0 C-N-CA 124.22 1.008 . . . . 0.0 108.957 173.491 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -87.0 -9.11 6.42 Favored 'Trans proline' 0 CA--C 1.536 0.586 0 C-N-CA 124.583 3.522 . . . . 0.0 114.54 -169.144 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 63.48 -24.63 0.07 Allowed 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 127.826 2.45 . . . . 0.0 114.627 -168.408 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 80.6 p -64.53 -18.91 65.26 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 124.989 1.315 . . . . 0.0 111.995 169.333 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 33.5 p -65.56 -8.24 18.86 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 126.692 1.997 . . . . 0.0 114.184 168.493 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? 68.26 -36.78 0.32 Allowed 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 128.408 2.683 . . . . 0.0 116.644 169.751 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 28.9 t0 -125.54 14.24 8.17 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 125.167 1.387 . . . . 0.0 113.45 178.319 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 80.2 mtp 56.63 22.48 6.77 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 126.276 1.83 . . . . 0.0 114.368 -179.49 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -133.3 152.51 51.93 Favored 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 125.818 1.647 . . . . 0.0 112.012 -170.089 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 10.5 m-85 -148.82 156.43 42.33 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 125.527 1.531 . . . . 0.0 111.823 171.495 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 47.2 tttp -85.81 153.01 22.57 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 124.385 1.074 . . . . 0.0 113.248 -178.634 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 13.7 t -104.89 101.78 31.49 Favored Pre-proline 0 CA--C 1.547 0.831 0 C-N-CA 126.559 1.943 . . . . 0.0 109.128 165.017 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -61.33 -21.16 71.02 Favored 'Trans proline' 0 CA--C 1.541 0.825 0 C-N-CA 122.726 2.284 . . . . 0.0 115.496 176.76 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 89.3 mt -72.87 -58.07 5.71 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 C-N-CA 124.495 1.118 . . . . 0.0 111.658 -177.691 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 14.4 p -98.12 2.62 48.77 Favored 'General case' 0 CA--C 1.552 1.055 0 C-N-CA 123.977 0.911 . . . . 0.0 113.346 179.406 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 568' ' ' LYS . . . . . . . . . . . . 0.326 20.1 ptpt 54.85 42.85 30.81 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 127.566 2.346 . . . . 0.0 113.434 -177.401 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 71.2 mm-40 -109.84 -177.27 3.22 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.624 0.77 . . . . 0.0 112.196 179.26 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 64.4 m -132.34 120.99 22.82 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 124.556 1.142 . . . . 0.0 110.977 178.218 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -81.74 149.77 4.73 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 C-N-CA 124.456 1.102 . . . . 0.0 110.258 168.056 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 3.4 t -149.0 155.62 41.06 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.969 0.907 . . . . 0.0 112.388 171.436 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -58.47 148.28 38.09 Favored Glycine 0 CA--C 1.534 1.251 0 C-N-CA 126.18 1.848 . . . . 0.0 116.661 -168.648 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 60.8 t -136.2 132.6 49.76 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 C-N-CA 125.691 1.596 . . . . 0.0 111.567 173.413 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 57.7 t80 -73.67 127.69 33.46 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 113.327 0.862 . . . . 0.0 113.327 -175.113 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 22.7 t0 -99.37 122.76 42.95 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 125.705 1.602 . . . . 0.0 110.45 169.237 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 64.7 mt-10 -73.55 -24.27 60.1 Favored 'General case' 0 CA--C 1.544 0.74 0 N-CA-C 113.793 1.035 . . . . 0.0 113.793 177.94 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -77.16 -52.48 9.2 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 119.401 1.001 . . . . 0.0 112.115 -176.234 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 89.9 p -74.42 -24.98 59.17 Favored 'General case' 0 N--CA 1.479 0.995 0 O-C-N 121.548 -0.72 . . . . 0.0 112.048 169.296 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 78.31 28.81 55.06 Favored Glycine 0 CA--C 1.536 1.403 0 C-N-CA 124.501 1.048 . . . . 0.0 113.15 -179.62 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -143.2 159.03 43.07 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.718 1.607 . . . . 0.0 112.645 -172.304 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 82.3 m95 -78.73 137.39 37.75 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.805 0.842 . . . . 0.0 111.677 176.946 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 19.2 m -130.0 151.28 35.62 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.762 0 C-N-CA 126.261 1.824 . . . . 0.0 112.912 -178.032 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 5.7 m0 -97.09 104.35 16.36 Favored 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 126.452 1.901 . . . . 0.0 110.553 169.321 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -70.87 148.39 47.85 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 124.221 1.009 . . . . 0.0 111.987 179.091 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 48.3 t30 50.45 45.48 26.34 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 124.855 1.262 . . . . 0.0 112.518 -179.785 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 94.2 m -130.93 145.84 52.15 Favored 'General case' 0 N--CA 1.48 1.052 0 N-CA-C 113.95 1.092 . . . . 0.0 113.95 -170.113 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 8.3 tt -143.33 151.72 16.89 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.62 0 C-N-CA 128.078 2.551 . . . . 0.0 110.477 -177.792 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 73.1 tt0 -119.03 126.8 52.55 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.338 1.455 . . . . 0.0 109.792 169.696 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 2.8 t -142.01 131.98 24.22 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 C-N-CA 126.78 2.032 . . . . 0.0 109.868 -175.795 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 16.5 m120 52.44 36.87 21.22 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 124.91 1.284 . . . . 0.0 113.931 178.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 78.67 8.93 87.47 Favored Glycine 0 CA--C 1.54 1.625 0 C-N-CA 124.796 1.189 . . . . 0.0 115.518 -179.752 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 53.0 mtmt -126.56 148.57 49.73 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 126.209 1.804 . . . . 0.0 111.431 -178.646 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 20.9 m-85 -89.58 149.12 22.99 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.167 0.987 . . . . 0.0 111.979 177.004 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 94.2 m-85 -151.34 162.85 40.18 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 125.783 1.633 . . . . 0.0 111.345 -179.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 596' ' ' HIS . . . . . 0.407 ' HB2' ' HB2' ' A' ' 599' ' ' CYS . 24.6 m80 -78.44 140.58 38.64 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 167.901 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 19.7 m -64.86 -39.52 93.68 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 118.36 0.527 . . . . 0.0 111.673 179.223 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 22.6 p -62.4 -46.08 90.24 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 123.721 0.808 . . . . 0.0 112.943 172.781 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 599' ' ' CYS . . . . . 0.407 ' HB2' ' HB2' ' A' ' 596' ' ' HIS . 94.0 m -60.04 -54.41 46.35 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 124.226 1.01 . . . . 0.0 111.312 177.883 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 89.7 t80 -62.32 -41.71 98.77 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.293 0.637 . . . . 0.0 112.126 -179.18 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 12.9 t-160 -61.29 -44.36 97.34 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.087 0.955 . . . . 0.0 112.388 176.348 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 25.8 tt0 -71.94 -34.39 68.98 Favored 'General case' 0 CA--C 1.545 0.788 0 N-CA-C 113.291 0.849 . . . . 0.0 113.291 178.612 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 92.1 m -89.51 -42.41 11.47 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 113.871 1.063 . . . . 0.0 113.871 -172.26 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 604' ' ' SER . . . . . . . . . . . . . 8.5 t -83.68 72.88 10.31 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 113.617 0.969 . . . . 0.0 113.617 -169.293 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 605' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -66.31 -20.76 66.18 Favored 'General case' 0 CA--C 1.544 0.75 0 O-C-N 121.319 -0.863 . . . . 0.0 112.293 172.07 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 606' ' ' ASN . . . . . . . . . . . . . 82.6 m-20 -67.93 -25.44 65.47 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.373 1.069 . . . . 0.0 113.356 175.538 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 607' ' ' SER . . . . . . . . . . . . . 14.1 t -74.12 -16.95 61.0 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.83 1.252 . . . . 0.0 113.872 -179.386 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 608' ' ' SER . . . . . . . . . . . . . 49.5 m . . . . . 0 C--O 1.253 1.286 0 C-N-CA 126.262 1.825 . . . . 0.0 114.348 -178.788 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 533' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.635 0 N-CA-C 111.498 -0.641 . . . . 0.0 111.498 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . -72.12 158.89 53.55 Favored Glycine 0 CA--C 1.539 1.541 0 C-N-CA 124.211 0.91 . . . . 0.0 114.195 178.256 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 535' ' ' SER . . . . . . . . . . . . . 27.0 m -65.7 141.94 58.19 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.792 1.237 . . . . 0.0 112.918 179.764 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 536' ' ' GLU . . . . . . . . . . . . . 70.7 mt-10 -78.52 149.41 33.11 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 124.437 1.095 . . . . 0.0 112.706 175.896 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 537' ' ' PHE . . . . . . . . . . . . . 37.1 p90 -80.87 158.81 25.21 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 124.822 1.249 . . . . 0.0 112.872 175.248 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 22.0 t -70.75 154.29 41.99 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 125.127 1.371 . . . . 0.0 113.546 -178.739 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 539' ' ' ASP . . . . . . . . . . . . . 33.0 p30 -137.16 160.76 38.05 Favored 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 126.411 1.884 . . . . 0.0 112.336 175.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 540' ' ' ARG . . . . . . . . . . . . . 27.5 mmm180 -103.49 24.45 11.04 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 125.355 1.462 . . . . 0.0 114.041 -169.082 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 20.4 m -60.7 149.15 36.26 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 125.821 1.648 . . . . 0.0 114.502 -171.64 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 542' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -62.08 -18.14 59.78 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 124.906 1.282 . . . . 0.0 114.17 -177.777 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -59.29 -23.46 62.43 Favored 'General case' 0 N--CA 1.476 0.847 0 O-C-N 120.965 -1.085 . . . . 0.0 113.331 172.013 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 76.1 mt -82.38 -18.27 42.59 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.01 1.324 . . . . 0.0 113.479 172.254 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 35.2 tp10 -91.34 -37.52 13.19 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 124.842 1.257 . . . . 0.0 113.108 -176.397 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 29.6 mm -60.96 -38.09 78.59 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.014 0 CA-C-N 118.828 0.74 . . . . 0.0 111.333 175.691 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 19.8 ptp180 -75.43 -17.8 60.07 Favored 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 113.575 0.954 . . . . 0.0 113.575 -179.676 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -80.88 -9.57 86.13 Favored Glycine 0 CA--C 1.531 1.094 0 C-N-CA 124.77 1.176 . . . . 0.0 114.562 -179.38 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 69.3 mmtt -73.58 143.68 46.31 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 118.522 1.161 . . . . 0.0 112.221 179.581 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 40.6 p90 -159.69 167.21 28.9 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 125.292 1.437 . . . . 0.0 111.886 173.848 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 2.6 m -133.65 141.9 43.0 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.725 0 C-N-CA 125.928 1.691 . . . . 0.0 110.252 171.22 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 7.4 p -76.47 137.22 23.04 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.059 0 O-C-N 121.156 -0.965 . . . . 0.0 112.642 -170.241 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 72.5 t -75.64 125.68 88.23 Favored Pre-proline 0 N--CA 1.472 0.631 0 C-N-CA 124.475 1.11 . . . . 0.0 109.696 171.554 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_endo -78.34 142.67 19.05 Favored 'Trans proline' 0 CA--C 1.539 0.772 0 C-N-CA 122.994 2.463 . . . . 0.0 111.154 173.538 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -63.18 -17.38 62.33 Favored 'General case' 0 N--CA 1.48 1.037 0 O-C-N 121.016 -1.053 . . . . 0.0 113.063 172.36 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 11.3 m -64.93 -27.04 68.58 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 125.782 1.633 . . . . 0.0 112.71 171.481 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 29.2 t -70.6 125.86 27.99 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-N 119.12 0.873 . . . . 0.0 111.907 179.484 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 45.8 tt0 -74.99 -27.14 60.03 Favored 'General case' 0 CA--C 1.55 0.948 0 N-CA-C 112.953 0.723 . . . . 0.0 112.953 176.402 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 20.3 t0 -118.98 -11.37 9.69 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 114.328 1.233 . . . . 0.0 114.328 -172.363 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 79.8 mtp 56.98 34.85 25.58 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 125.976 1.71 . . . . 0.0 113.391 177.566 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -139.63 153.63 47.37 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 115.586 1.699 . . . . 0.0 115.586 -169.579 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 19.9 m-85 -148.18 174.3 12.12 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 128.449 2.699 . . . . 0.0 108.75 169.734 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 7.3 ttpm? -132.15 142.18 49.38 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 124.287 1.035 . . . . 0.0 113.114 -175.059 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 22.3 t -83.11 114.99 56.58 Favored Pre-proline 0 CA--C 1.546 0.819 0 C-N-CA 127.948 2.499 . . . . 0.0 111.03 172.778 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -63.5 -26.38 70.14 Favored 'Trans proline' 0 CA--C 1.538 0.705 0 C-N-CA 123.144 2.563 . . . . 0.0 114.985 173.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 89.8 mt -70.35 -55.44 14.51 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.885 0 C-N-CA 124.359 1.063 . . . . 0.0 111.552 -173.581 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 14.3 p -103.54 1.13 31.85 Favored 'General case' 0 CA--C 1.553 1.086 0 C-N-CA 124.79 1.236 . . . . 0.0 113.587 179.725 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 568' ' ' LYS . . . . . . . . . . . . . 29.6 mtpp 60.65 41.45 15.21 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 126.447 1.899 . . . . 0.0 112.448 -179.832 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 77.1 mt-10 -114.23 133.89 55.31 Favored 'General case' 0 N--CA 1.486 1.331 0 N-CA-C 114.208 1.188 . . . . 0.0 114.208 -174.033 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 89.3 m -83.58 118.43 23.8 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 124.051 0.94 . . . . 0.0 111.289 177.573 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 3.5 m -81.95 149.09 4.91 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 124.566 1.146 . . . . 0.0 110.715 168.805 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 82.3 p -133.08 156.36 47.54 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 125.504 1.522 . . . . 0.0 111.273 177.008 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -65.58 140.82 41.39 Favored Glycine 0 CA--C 1.532 1.109 0 N-CA-C 115.043 0.777 . . . . 0.0 115.043 -178.763 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 85.6 t -134.49 131.47 54.39 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 C-N-CA 125.236 1.414 . . . . 0.0 110.492 178.489 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 74.6 t80 -73.89 123.9 25.13 Favored 'General case' 0 CA--C 1.543 0.673 0 N-CA-C 113.573 0.953 . . . . 0.0 113.573 -173.731 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 54.0 t0 -92.64 114.93 27.62 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.214 1.406 . . . . 0.0 109.559 169.233 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -71.32 -27.07 63.13 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 114.062 1.134 . . . . 0.0 114.062 -175.648 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 50.1 mm-40 -88.18 -39.26 14.64 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 124.282 1.033 . . . . 0.0 112.034 -179.591 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 32.4 t -70.84 -35.01 72.24 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 122.964 0.506 . . . . 0.0 112.058 169.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 81.35 25.57 54.19 Favored Glycine 0 CA--C 1.534 1.222 0 C-N-CA 125.058 1.313 . . . . 0.0 112.921 -176.482 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 78.8 mm-40 -141.57 152.65 44.25 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.89 1.276 . . . . 0.0 111.876 -170.461 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 84.2 m95 -77.06 138.68 39.7 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 123.862 0.865 . . . . 0.0 110.757 171.584 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 23.4 m -135.24 148.72 28.63 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 C-N-CA 125.415 1.486 . . . . 0.0 113.31 -175.63 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 4.1 m0 -87.63 99.62 12.2 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 126.534 1.934 . . . . 0.0 109.169 169.694 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 32.6 mmtp -68.72 148.44 50.37 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 124.093 0.957 . . . . 0.0 111.881 -178.245 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 64.2 t30 53.63 33.43 16.47 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 125.763 1.625 . . . . 0.0 113.144 179.221 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 90.1 m -116.87 142.83 46.43 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 124.05 0.94 . . . . 0.0 112.645 -171.736 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 11.1 tt -134.94 144.91 33.29 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 C-N-CA 127.71 2.404 . . . . 0.0 110.116 -179.638 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 73.6 tt0 -112.18 136.99 50.89 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 124.683 1.193 . . . . 0.0 110.713 171.272 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 12.7 p -148.56 136.12 13.97 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 C-N-CA 124.421 1.088 . . . . 0.0 110.925 172.268 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 66.0 t30 51.22 37.21 17.87 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 125.038 1.335 . . . . 0.0 113.537 177.761 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 78.1 8.3 87.44 Favored Glycine 0 CA--C 1.537 1.424 0 C-N-CA 124.829 1.204 . . . . 0.0 116.086 -179.279 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -122.94 149.61 44.04 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 125.92 1.688 . . . . 0.0 111.879 -178.147 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 72.6 m-85 -98.69 147.12 25.17 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.633 1.173 . . . . 0.0 113.176 -179.665 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 98.6 m-85 -150.85 168.89 23.1 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 126.551 1.94 . . . . 0.0 110.706 179.664 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 596' ' ' HIS . . . . . . . . . . . . . 22.8 m80 -86.17 144.17 27.62 Favored 'General case' 0 N--CA 1.471 0.605 0 O-C-N 121.288 -0.882 . . . . 0.0 110.08 168.057 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 15.6 m -65.35 -43.54 90.55 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 123.42 0.688 . . . . 0.0 111.969 179.888 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 22.2 p -64.64 -37.69 88.44 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 124.013 0.925 . . . . 0.0 112.966 174.29 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 599' ' ' CYS . . . . . . . . . . . . . 89.6 m -65.86 -59.76 3.54 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.135 0.974 . . . . 0.0 110.965 176.211 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 75.8 t80 -59.13 -38.39 79.52 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.169 0.988 . . . . 0.0 113.481 -175.245 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 76.6 t60 -56.69 -58.3 8.69 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 114.712 1.375 . . . . 0.0 114.712 -173.198 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 15.2 tt0 -98.14 -10.87 23.5 Favored 'General case' 0 CA--C 1.545 0.767 0 N-CA-C 113.637 0.977 . . . . 0.0 113.637 -174.387 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 98.6 m -80.77 -35.42 33.23 Favored 'General case' 0 N--CA 1.485 1.276 0 O-C-N 121.157 -0.964 . . . . 0.0 112.242 179.42 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 604' ' ' SER . . . . . . . . . . . . . 23.3 t -68.11 150.26 48.6 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 123.582 0.753 . . . . 0.0 112.678 178.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 605' ' ' GLN . . . . . . . . . . . . . 64.7 tt0 -74.95 83.82 2.23 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 124.153 0.981 . . . . 0.0 110.194 171.813 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 606' ' ' ASN . . . . . . . . . . . . . 81.6 m-20 -67.71 161.01 26.89 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 124.331 1.053 . . . . 0.0 112.424 177.626 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 607' ' ' SER . . . . . . . . . . . . . 22.8 t -139.31 157.85 45.18 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 125.136 1.374 . . . . 0.0 112.364 -175.641 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 608' ' ' SER . . . . . . . . . . . . . 26.9 m . . . . . 0 C--O 1.253 1.267 0 C-N-CA 126.643 1.977 . . . . 0.0 114.052 -175.576 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 533' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.527 0 N-CA-C 111.297 -0.721 . . . . 0.0 111.297 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . -79.72 -8.3 87.82 Favored Glycine 0 CA--C 1.539 1.577 0 N-CA-C 115.864 1.105 . . . . 0.0 115.864 -177.787 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 535' ' ' SER . . . . . . . . . . . . . 9.1 t -152.62 167.61 28.33 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.38 1.472 . . . . 0.0 111.92 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 536' ' ' GLU . . . . . . . . . . . . . 17.1 pt-20 -69.05 155.77 39.79 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 124.764 1.226 . . . . 0.0 113.795 -179.75 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 537' ' ' PHE . . . . . . . . . . . . . 95.5 m-85 -71.31 148.99 46.55 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 124.015 0.926 . . . . 0.0 112.706 175.004 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 77.7 p -76.24 166.06 24.0 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 124.057 0.943 . . . . 0.0 112.624 173.213 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 539' ' ' ASP . . . . . . . . . . . . . 29.3 t0 -78.36 18.52 0.53 Allowed 'General case' 0 CA--C 1.553 1.094 0 C-N-CA 125.495 1.518 . . . . 0.0 114.281 -178.178 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 540' ' ' ARG . . . . . . . . . . . . . 84.3 mtt85 -69.8 153.85 42.78 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 125.25 1.42 . . . . 0.0 112.774 179.487 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 79.6 p -68.82 156.5 38.29 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.887 1.275 . . . . 0.0 112.634 171.571 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 542' ' ' ASN . . . . . . . . . . . . . 30.9 t-20 -72.6 126.76 30.65 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 123.855 0.862 . . . . 0.0 111.715 -177.419 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -113.74 -26.17 8.34 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 125.488 1.515 . . . . 0.0 113.232 172.416 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 63.6 tp -63.77 -40.22 96.16 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.986 0.914 . . . . 0.0 112.59 -177.336 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 63.3 mt-10 -74.32 -18.82 60.65 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 113.425 0.898 . . . . 0.0 113.425 176.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 16.7 mm -75.0 -41.76 45.69 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.554 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 168.764 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 7.3 tmm_? -66.37 -36.35 82.65 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 124.111 0.964 . . . . 0.0 111.39 178.919 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -67.15 -6.4 39.02 Favored Glycine 0 CA--C 1.535 1.307 0 C-N-CA 125.704 1.621 . . . . 0.0 116.561 175.801 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt -70.95 134.37 47.14 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-N 119.754 1.777 . . . . 0.0 110.991 171.494 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 41.6 p90 -148.49 166.74 27.29 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 114.443 1.275 . . . . 0.0 114.443 179.697 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -136.91 138.99 45.4 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 C-N-CA 126.776 2.03 . . . . 0.0 109.241 173.722 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 83.8 t -70.48 132.02 33.67 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.994 0 O-C-N 121.043 -1.036 . . . . 0.0 110.908 -174.701 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 87.3 t -71.72 124.87 91.55 Favored Pre-proline 0 CA--C 1.541 0.629 0 C-N-CA 125.331 1.453 . . . . 0.0 109.963 175.268 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 95.5 Cg_endo -78.87 152.21 24.92 Favored 'Trans proline' 0 C--N 1.349 0.567 0 C-N-CA 123.036 2.49 . . . . 0.0 112.19 177.293 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 56.1 mt-10 -62.54 -21.67 65.74 Favored 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 113.215 0.82 . . . . 0.0 113.215 174.001 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 67.8 p -78.61 -11.85 59.99 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 125.89 1.676 . . . . 0.0 113.882 176.104 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 88.5 p -63.7 144.26 57.17 Favored 'General case' 0 N--CA 1.48 1.032 0 CA-C-N 119.242 0.928 . . . . 0.0 112.756 178.062 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 64.5 mt-30 -83.12 118.62 23.7 Favored 'General case' 0 N--CA 1.467 0.404 0 O-C-N 121.449 -0.782 . . . . 0.0 109.287 169.657 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 38.0 m-20 52.15 24.31 2.7 Favored 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 126.415 1.886 . . . . 0.0 115.197 177.47 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 8.9 mtt 54.75 36.21 25.81 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.97 1.308 . . . . 0.0 113.65 -176.453 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -125.03 147.09 49.13 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 114.368 1.247 . . . . 0.0 114.368 -171.491 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 6.5 t80 -155.48 166.4 33.66 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 125.611 1.564 . . . . 0.0 111.084 172.193 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 39.5 ttmt -107.61 148.7 28.97 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 124.907 1.283 . . . . 0.0 114.352 -171.129 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 33.9 t -95.15 110.45 50.28 Favored Pre-proline 0 CA--C 1.543 0.709 0 C-N-CA 128.384 2.674 . . . . 0.0 110.033 167.905 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -64.66 -21.7 65.05 Favored 'Trans proline' 0 CA--C 1.538 0.701 0 C-N-CA 123.037 2.491 . . . . 0.0 115.425 177.649 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 85.0 mt -70.95 -55.46 13.99 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.928 0 C-N-CA 124.025 0.93 . . . . 0.0 110.873 -177.436 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 14.7 p -103.38 0.1 30.83 Favored 'General case' 0 CA--C 1.552 1.052 0 N-CA-C 113.909 1.078 . . . . 0.0 113.909 -178.251 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 568' ' ' LYS . . . . . . . . . . . . 0.332 25.0 pttm 55.32 46.1 24.18 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 127.775 2.43 . . . . 0.0 113.419 -175.481 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 69.6 mm-40 -121.16 150.15 41.72 Favored 'General case' 0 N--CA 1.483 1.176 0 N-CA-C 113.715 1.006 . . . . 0.0 113.715 -175.583 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 89.1 m -93.46 120.79 34.16 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 124.108 0.963 . . . . 0.0 112.303 -176.111 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 2.6 m -79.14 147.16 6.94 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.671 0 C-N-CA 124.215 1.006 . . . . 0.0 110.084 167.326 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 68.6 p -127.53 148.05 50.33 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 124.52 1.128 . . . . 0.0 111.386 175.547 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -70.75 147.39 43.34 Favored Glycine 0 CA--C 1.534 1.26 0 C-N-CA 123.887 0.756 . . . . 0.0 114.001 -178.55 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 85.9 t -133.62 136.37 54.42 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 C-N-CA 125.362 1.465 . . . . 0.0 111.185 177.235 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 63.8 t80 -72.99 118.87 16.47 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 123.478 0.711 . . . . 0.0 112.78 -176.622 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 63.4 t0 -82.68 110.52 17.81 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 168.436 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 57.9 mt-10 -68.12 -25.86 65.51 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 124.692 1.197 . . . . 0.0 113.946 -175.445 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 38.0 tp10 -80.51 -48.44 12.78 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 123.255 0.622 . . . . 0.0 112.229 -176.371 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 99.1 p -78.82 -28.72 44.48 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 123.52 0.728 . . . . 0.0 112.473 173.416 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 82.15 31.13 32.34 Favored Glycine 0 CA--C 1.538 1.474 0 C-N-CA 124.853 1.216 . . . . 0.0 112.606 -177.049 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 56.2 mt-10 -135.34 145.59 47.57 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 118.636 1.218 . . . . 0.0 111.311 -173.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 69.9 m95 -77.54 141.02 39.82 Favored 'General case' 0 N--CA 1.466 0.342 0 O-C-N 121.273 -0.892 . . . . 0.0 111.523 177.235 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 17.3 m -135.91 142.59 38.6 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 C-N-CA 125.853 1.661 . . . . 0.0 112.757 -172.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 2.0 m0 -88.97 95.36 10.29 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 125.175 1.39 . . . . 0.0 108.019 170.168 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -69.5 160.94 30.51 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 124.291 1.036 . . . . 0.0 111.396 175.007 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 54.61 32.05 16.31 Favored 'General case' 0 CA--C 1.553 1.074 0 C-N-CA 125.04 1.336 . . . . 0.0 112.607 -177.92 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 73.0 m -125.15 146.73 49.36 Favored 'General case' 0 N--CA 1.479 0.984 0 O-C-N 120.978 -1.077 . . . . 0.0 113.564 -169.492 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 18.1 tt -143.19 149.29 18.55 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 C-N-CA 127.085 2.154 . . . . 0.0 110.85 177.924 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 72.6 tt0 -107.89 122.27 46.45 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 124.482 1.113 . . . . 0.0 110.002 168.744 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 2.0 t -144.16 142.11 24.29 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.866 0 C-N-CA 126.332 1.853 . . . . 0.0 109.682 -174.559 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 23.8 t-20 52.27 26.64 4.14 Favored 'General case' 0 CA--C 1.554 1.128 0 C-N-CA 125.526 1.531 . . . . 0.0 114.189 177.537 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 88.42 1.79 80.6 Favored Glycine 0 CA--C 1.54 1.646 0 C-N-CA 125.721 1.629 . . . . 0.0 116.455 -177.786 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 2.7 mptt -128.43 161.18 30.08 Favored 'General case' 0 N--CA 1.479 1.01 0 CA-C-N 119.42 1.61 . . . . 0.0 113.285 -177.823 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 3.6 m-85 -81.78 148.9 28.65 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 115.541 -0.754 . . . . 0.0 111.59 171.746 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 64.2 m-85 -152.87 161.79 42.11 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 126.334 1.853 . . . . 0.0 110.854 -178.106 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 596' ' ' HIS . . . . . 0.413 ' HB2' ' HB2' ' A' ' 599' ' ' CYS . 21.1 m80 -76.97 136.14 38.73 Favored 'General case' 0 N--CA 1.473 0.698 0 N-CA-C 108.259 -1.015 . . . . 0.0 108.259 167.222 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 47.8 p -59.39 -37.45 77.99 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 123.532 0.733 . . . . 0.0 112.375 178.114 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 5.7 p -70.31 -50.51 38.48 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.723 1.209 . . . . 0.0 112.637 175.171 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 599' ' ' CYS . . . . . 0.413 ' HB2' ' HB2' ' A' ' 596' ' ' HIS . 91.4 m -51.51 -52.26 48.34 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.278 1.031 . . . . 0.0 111.423 175.007 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 53.6 t80 -58.51 -52.21 66.61 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 123.483 0.713 . . . . 0.0 111.734 176.605 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 51.6 t-80 -61.81 -38.53 88.48 Favored 'General case' 0 N--CA 1.475 0.824 0 N-CA-C 113.372 0.878 . . . . 0.0 113.372 -176.489 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -71.07 -18.9 62.53 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 113.736 1.014 . . . . 0.0 113.736 175.567 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 88.7 m -101.25 -65.94 0.94 Allowed 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 124.624 1.17 . . . . 0.0 112.132 -177.733 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 604' ' ' SER . . . . . . . . . . . . . 52.0 m 55.22 -49.67 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 129.742 3.217 . . . . 0.0 117.816 -174.488 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 605' ' ' GLN . . . . . . . . . . . . . 59.5 mm-40 -77.8 156.51 30.44 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 126.335 1.854 . . . . 0.0 113.269 -174.518 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 606' ' ' ASN . . . . . . . . . . . . . 67.1 t30 50.47 60.85 3.55 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 126.566 1.946 . . . . 0.0 114.717 168.721 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 607' ' ' SER . . . . . . . . . . . . . 33.4 t -61.88 -34.03 75.27 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 113.754 1.02 . . . . 0.0 113.754 -175.885 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 608' ' ' SER . . . . . . . . . . . . . 22.7 t . . . . . 0 C--O 1.255 1.38 0 C-N-CA 125.655 1.582 . . . . 0.0 112.471 175.457 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 533' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.614 0 N-CA-C 111.75 -0.54 . . . . 0.0 111.75 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . -179.52 81.55 0.06 OUTLIER Glycine 0 CA--C 1.532 1.111 0 C-N-CA 124.317 0.961 . . . . 0.0 112.599 -179.652 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 535' ' ' SER . . . . . . . . . . . . . 36.9 t -66.94 -35.26 79.59 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 124.152 0.981 . . . . 0.0 112.866 -178.641 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 536' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -151.24 145.42 25.36 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.658 1.583 . . . . 0.0 110.591 173.479 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 537' ' ' PHE . . . . . . . . . . . . . 84.9 m-85 -92.83 -2.34 55.99 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 114.902 1.445 . . . . 0.0 114.902 -170.841 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 28.5 t -153.27 144.44 23.04 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 124.666 1.187 . . . . 0.0 112.519 -179.531 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 539' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -152.65 167.25 29.53 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 126.117 1.767 . . . . 0.0 110.514 172.218 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 540' ' ' ARG . . . . . . . . . . . . . 3.7 tpt180 -106.42 11.66 30.59 Favored 'General case' 0 N--CA 1.479 1.007 0 N-CA-C 115.242 1.571 . . . . 0.0 115.242 -171.202 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 40.6 t -70.48 129.64 39.78 Favored 'General case' 0 N--CA 1.473 0.689 0 O-C-N 121.21 -0.931 . . . . 0.0 111.861 177.762 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 542' ' ' ASN . . . . . . . . . . . . . 76.7 m-20 -75.68 -19.63 59.0 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 113.262 0.838 . . . . 0.0 113.262 176.347 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 71.2 tt0 -60.91 -27.91 68.53 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.152 0.981 . . . . 0.0 113.014 -177.15 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 58.4 tp -59.17 -40.84 86.89 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 123.918 0.887 . . . . 0.0 112.348 174.543 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 63.8 mm-40 -75.58 -19.29 59.37 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 125.048 1.339 . . . . 0.0 114.179 -173.804 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 31.1 mm -64.08 -36.51 77.12 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.687 0 C-N-CA 125.065 1.346 . . . . 0.0 112.712 -169.662 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 9.4 ptp180 -70.08 -10.86 60.11 Favored 'General case' 0 N--CA 1.478 0.971 0 N-CA-C 115.756 1.761 . . . . 0.0 115.756 -170.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -77.42 -14.56 82.37 Favored Glycine 0 CA--C 1.539 1.542 0 C-N-CA 123.905 0.765 . . . . 0.0 114.838 178.04 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -71.59 147.05 47.99 Favored 'General case' 0 N--CA 1.477 0.911 0 CA-C-N 118.831 1.316 . . . . 0.0 113.472 -177.118 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 51.6 p90 -154.84 162.48 41.09 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 125.603 1.561 . . . . 0.0 111.698 169.554 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -134.74 137.57 50.79 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 C-N-CA 125.899 1.68 . . . . 0.0 110.295 177.709 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 40.7 t -68.29 132.02 33.06 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 C-N-CA 123.671 0.788 . . . . 0.0 109.951 -179.122 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 21.2 t -73.66 123.69 89.61 Favored Pre-proline 0 N--CA 1.474 0.745 0 C-N-CA 124.144 0.978 . . . . 0.0 109.131 171.075 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_endo -70.59 146.32 54.76 Favored 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 122.5 2.133 . . . . 0.0 111.699 178.045 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -62.98 -18.77 63.64 Favored 'General case' 0 N--CA 1.474 0.75 0 O-C-N 121.367 -0.833 . . . . 0.0 113.157 174.184 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 18.7 m -58.53 -32.76 69.16 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 124.943 1.297 . . . . 0.0 111.726 169.296 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 19.7 t -81.73 101.57 10.19 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.623 0.769 . . . . 0.0 111.372 172.079 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 93.0 mt-30 -71.86 -30.66 65.67 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 123.289 0.636 . . . . 0.0 112.242 175.071 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 76.5 m-20 -91.12 -19.7 22.83 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.152 0.981 . . . . 0.0 113.456 -177.348 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 6.2 mtt 55.76 33.08 20.72 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 125.815 1.646 . . . . 0.0 114.95 178.779 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -133.25 136.61 45.66 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.027 0.931 . . . . 0.0 113.24 -175.317 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -143.61 161.1 39.38 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 126.329 1.852 . . . . 0.0 110.753 175.53 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 23.7 tptt -94.75 157.85 15.77 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 124.442 1.097 . . . . 0.0 113.626 -173.957 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 15.2 t -109.98 96.45 25.08 Favored Pre-proline 0 CA--C 1.547 0.838 0 C-N-CA 126.755 2.022 . . . . 0.0 107.566 165.659 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -60.06 -17.61 46.1 Favored 'Trans proline' 0 CA--C 1.548 1.183 0 C-N-CA 122.586 2.191 . . . . 0.0 115.342 177.325 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 73.0 mt -72.58 -58.25 5.41 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.892 0 C-N-CA 124.81 1.244 . . . . 0.0 111.076 -179.942 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 13.7 p -101.93 1.64 37.04 Favored 'General case' 0 CA--C 1.553 1.074 0 N-CA-C 113.964 1.098 . . . . 0.0 113.964 -179.24 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 568' ' ' LYS . . . . . . . . . . . . . 53.6 mtmt 62.37 36.38 14.45 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 128.125 2.57 . . . . 0.0 113.322 -179.033 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 51.2 mm-40 -100.71 173.03 6.72 Favored 'General case' 0 N--CA 1.481 1.124 0 O-C-N 121.731 -0.606 . . . . 0.0 112.539 -177.796 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 59.2 m -118.26 120.97 39.25 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 124.542 1.137 . . . . 0.0 110.71 172.81 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 1.5 m -83.28 121.51 36.26 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.726 0 C-N-CA 124.837 1.255 . . . . 0.0 109.667 169.169 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 47.6 p -106.17 141.72 37.06 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 124.822 1.249 . . . . 0.0 111.263 175.002 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -65.91 148.27 50.88 Favored Glycine 0 CA--C 1.528 0.873 0 C-N-CA 124.099 0.857 . . . . 0.0 113.438 179.241 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 65.0 t -131.21 129.01 62.49 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 C-N-CA 125.743 1.617 . . . . 0.0 111.25 179.909 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 35.1 t80 -74.74 124.38 26.66 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 113.004 0.742 . . . . 0.0 113.004 -175.144 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 64.0 t0 -90.61 106.37 18.46 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.92 1.288 . . . . 0.0 109.156 168.609 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 57.7 mt-10 -66.54 -26.38 67.11 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.051 0.94 . . . . 0.0 113.427 -178.324 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -81.82 -44.72 16.55 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 124.38 1.072 . . . . 0.0 111.798 -178.642 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 53.9 m -77.37 -26.88 52.33 Favored 'General case' 0 N--CA 1.476 0.859 0 N-CA-C 112.946 0.721 . . . . 0.0 112.946 174.318 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 76.99 29.05 57.66 Favored Glycine 0 CA--C 1.539 1.561 0 C-N-CA 125.052 1.311 . . . . 0.0 113.52 -176.445 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 77.4 mm-40 -139.24 150.91 46.05 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 125.839 1.656 . . . . 0.0 111.164 -173.256 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 67.7 m95 -84.73 146.07 27.6 Favored 'General case' 0 N--CA 1.468 0.427 0 O-C-N 121.396 -0.815 . . . . 0.0 110.852 173.468 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 27.9 m -133.49 151.75 33.98 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.977 0 C-N-CA 125.838 1.655 . . . . 0.0 113.678 -178.382 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 3.3 m0 -105.22 107.89 19.12 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 127.241 2.217 . . . . 0.0 107.128 171.606 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -86.24 149.62 24.95 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 125.013 1.325 . . . . 0.0 112.594 -174.791 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 65.0 t30 50.8 32.57 7.31 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 126.106 1.762 . . . . 0.0 113.008 -169.576 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 98.0 m -113.81 146.57 39.76 Favored 'General case' 0 N--CA 1.476 0.833 0 O-C-N 120.92 -1.113 . . . . 0.0 111.993 -172.685 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 9.3 tt -127.55 137.52 57.44 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 C-N-CA 126.779 2.031 . . . . 0.0 110.783 175.101 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -94.98 130.86 41.46 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 125.302 1.441 . . . . 0.0 110.185 169.484 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 12.7 p -150.84 132.42 5.15 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 C-N-CA 124.813 1.245 . . . . 0.0 111.254 174.472 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 77.3 m-20 52.04 40.06 27.65 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 124.935 1.294 . . . . 0.0 114.484 174.504 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 77.4 10.24 86.36 Favored Glycine 0 CA--C 1.541 1.674 0 C-N-CA 125.39 1.472 . . . . 0.0 115.257 -178.866 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 48.6 mttp -133.2 171.65 13.73 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 126.885 2.074 . . . . 0.0 111.03 -170.837 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 84.6 m-85 -121.98 153.09 39.0 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 124.373 1.069 . . . . 0.0 113.673 -176.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 23.8 m-85 -151.87 164.82 36.29 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 126.986 2.115 . . . . 0.0 109.941 175.921 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 596' ' ' HIS . . . . . . . . . . . . . 25.5 m80 -77.76 138.67 39.14 Favored 'General case' 0 N--CA 1.468 0.46 0 N-CA-C 107.407 -1.331 . . . . 0.0 107.407 165.906 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 5.5 t -64.36 -39.07 93.14 Favored 'General case' 0 CA--C 1.539 0.539 0 O-C-N 121.597 -0.69 . . . . 0.0 111.952 -177.454 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 18.3 p -66.3 -37.28 85.05 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 124.735 1.214 . . . . 0.0 113.61 173.354 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 599' ' ' CYS . . . . . . . . . . . . . 72.3 m -63.88 -54.83 28.67 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 123.797 0.839 . . . . 0.0 110.644 173.337 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 75.9 t80 -57.97 -37.51 74.32 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 125.046 1.339 . . . . 0.0 112.665 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 11.8 t-160 -60.59 -35.52 76.3 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.231 1.012 . . . . 0.0 113.19 176.254 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -79.67 -33.35 41.28 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 113.65 0.982 . . . . 0.0 113.65 176.328 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 69.8 p -89.72 -25.89 20.94 Favored 'General case' 0 N--CA 1.48 1.032 0 N-CA-C 114.645 1.35 . . . . 0.0 114.645 -174.922 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 604' ' ' SER . . . . . . . . . . . . . 33.9 t -62.81 122.08 15.05 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 123.979 0.912 . . . . 0.0 112.064 -177.45 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 605' ' ' GLN . . . . . . . . . . . . . 42.4 mt-30 -148.79 164.09 35.44 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 126.981 2.112 . . . . 0.0 110.938 -176.307 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 606' ' ' ASN . . . . . . . . . . . . . 18.4 m120 55.71 43.87 27.25 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 125.271 1.428 . . . . 0.0 113.202 178.562 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 607' ' ' SER . . . . . . . . . . . . . 12.8 m -68.75 -9.84 53.04 Favored 'General case' 0 N--CA 1.478 0.942 0 N-CA-C 115.775 1.769 . . . . 0.0 115.775 -170.658 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 608' ' ' SER . . . . . . . . . . . . . 38.4 m . . . . . 0 C--O 1.252 1.232 0 C-N-CA 126.506 1.922 . . . . 0.0 114.073 -176.841 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 533' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.521 0 N-CA-C 111.063 -0.815 . . . . 0.0 111.063 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . -84.52 -25.83 41.39 Favored Glycine 0 CA--C 1.538 1.486 0 C-N-CA 124.42 1.01 . . . . 0.0 115.286 -178.934 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 535' ' ' SER . . . . . . . . . . . . . 94.6 p -157.0 0.83 0.12 Allowed 'General case' 0 N--CA 1.483 1.186 0 N-CA-C 115.575 1.694 . . . . 0.0 115.575 -174.499 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 536' ' ' GLU . . . . . . . . . . . . . 54.3 mp0 -69.28 -20.57 63.91 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.241 1.416 . . . . 0.0 113.759 -175.667 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 537' ' ' PHE . . . . . . . . . . . . . 81.0 m-85 -133.57 139.07 46.34 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.837 1.655 . . . . 0.0 111.446 -177.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 94.7 p -163.85 -162.64 0.72 Allowed 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 126.054 1.742 . . . . 0.0 110.099 -174.291 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 539' ' ' ASP . . . . . . . . . . . . . 66.6 m-20 -68.6 1.34 3.23 Favored 'General case' 0 CA--C 1.554 1.102 0 N-CA-C 114.167 1.173 . . . . 0.0 114.167 169.771 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 540' ' ' ARG . . . . . . . . . . . . . 52.6 ptt85 -56.52 155.88 6.77 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 125.611 1.565 . . . . 0.0 114.214 176.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 94.3 p -81.09 170.45 16.17 Favored 'General case' 0 C--O 1.24 0.596 0 C-N-CA 124.532 1.133 . . . . 0.0 111.794 169.114 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 542' ' ' ASN . . . . . . . . . . . . . 76.6 m-20 -87.1 -3.55 59.08 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 124.15 0.98 . . . . 0.0 113.052 169.947 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -62.33 -27.96 69.41 Favored 'General case' 0 N--CA 1.478 0.958 0 O-C-N 120.63 -1.294 . . . . 0.0 113.181 -174.211 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 80.5 mt -62.44 -29.45 70.52 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.665 1.186 . . . . 0.0 112.443 175.637 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 56.7 mt-10 -80.95 -19.33 44.41 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.556 1.143 . . . . 0.0 112.591 -177.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 14.6 mm -67.26 -31.93 55.26 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 C-N-CA 124.403 1.081 . . . . 0.0 111.232 176.721 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 39.3 mmt180 -58.19 -25.5 61.64 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 124.24 1.016 . . . . 0.0 112.799 171.856 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -79.88 -7.62 88.36 Favored Glycine 0 CA--C 1.536 1.394 0 C-N-CA 125.966 1.746 . . . . 0.0 115.013 -179.983 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 8.9 mmpt? -66.7 147.02 53.83 Favored 'General case' 0 N--CA 1.482 1.131 0 CA-C-N 119.811 1.805 . . . . 0.0 111.091 171.793 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 52.5 p90 -151.51 162.46 40.92 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.549 0.739 . . . . 0.0 112.787 171.193 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 1.6 m -130.44 134.69 61.94 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.926 0 C-N-CA 125.853 1.661 . . . . 0.0 109.74 173.075 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 10.0 p -67.8 138.01 23.5 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 O-C-N 121.616 -0.678 . . . . 0.0 111.731 -175.75 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 57.6 t -87.94 112.09 46.87 Favored Pre-proline 0 CA--C 1.544 0.744 0 C-N-CA 125.459 1.504 . . . . 0.0 108.941 170.19 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 67.5 Cg_endo -76.66 156.33 35.67 Favored 'Trans proline' 0 C--N 1.348 0.525 0 C-N-CA 122.62 2.213 . . . . 0.0 111.664 176.045 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 46.7 tt0 -58.02 -33.49 69.01 Favored 'General case' 0 CA--C 1.54 0.59 0 O-C-N 121.331 -0.856 . . . . 0.0 112.282 174.125 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 15.2 m -59.04 -25.98 64.18 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 125.463 1.505 . . . . 0.0 113.719 175.299 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 10.0 t -69.12 -23.61 64.0 Favored 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 113.092 0.775 . . . . 0.0 113.092 177.229 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 30.5 mt-30 59.35 -62.37 0.05 OUTLIER 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 129.211 3.005 . . . . 0.0 115.915 176.251 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 65.9 m-20 -82.21 -14.14 56.03 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 125.733 1.613 . . . . 0.0 113.374 -175.804 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 11.1 mtt 56.96 25.68 10.91 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 126.398 1.879 . . . . 0.0 114.976 179.582 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -131.42 144.75 51.42 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.265 1.026 . . . . 0.0 113.265 -171.748 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 4.5 t80 -153.84 -178.45 7.06 Favored 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 125.899 1.68 . . . . 0.0 109.668 173.131 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 5.2 tmmm? -137.05 134.17 36.25 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 125.027 1.331 . . . . 0.0 112.635 -178.695 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 30.9 t -69.55 117.17 50.4 Favored Pre-proline 0 CA--C 1.543 0.707 0 C-N-CA 126.681 1.993 . . . . 0.0 111.007 174.086 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_exo -65.11 -26.59 57.56 Favored 'Trans proline' 0 CA--C 1.542 0.885 0 C-N-CA 123.047 2.498 . . . . 0.0 114.646 175.739 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 80.6 mt -71.52 -57.46 7.44 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 C-N-CA 124.622 1.169 . . . . 0.0 111.418 -173.325 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 16.9 p -98.54 -1.86 40.1 Favored 'General case' 0 CA--C 1.549 0.932 0 N-CA-C 113.61 0.967 . . . . 0.0 113.61 179.276 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 568' ' ' LYS . . . . . . . . . . . . . 95.7 mttt 60.35 46.7 9.73 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 126.621 1.968 . . . . 0.0 112.778 -177.781 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 73.2 mm-40 -125.85 139.08 53.78 Favored 'General case' 0 N--CA 1.483 1.176 0 N-CA-C 115.481 1.66 . . . . 0.0 115.481 -174.24 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 24.4 m -69.66 138.51 53.07 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.734 1.214 . . . . 0.0 113.127 -179.109 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -112.73 140.07 34.5 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 C-N-CA 126.639 1.976 . . . . 0.0 109.904 167.841 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 44.4 p -130.42 144.03 51.14 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 125.377 1.471 . . . . 0.0 110.961 178.452 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -65.95 144.27 46.3 Favored Glycine 0 CA--C 1.53 1.006 0 C-N-CA 123.773 0.701 . . . . 0.0 114.093 -179.118 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 19.2 m -128.92 149.22 33.43 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 C-N-CA 125.68 1.592 . . . . 0.0 111.742 174.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 62.8 t80 -74.25 140.42 44.99 Favored 'General case' 0 CA--C 1.542 0.663 0 O-C-N 121.311 -0.868 . . . . 0.0 113.08 -175.94 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 21.1 t0 -115.81 118.53 33.28 Favored 'General case' 0 C--O 1.236 0.342 0 C-N-CA 126.776 2.031 . . . . 0.0 110.82 171.186 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 23.6 mp0 -74.27 -25.97 59.92 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 124.183 0.993 . . . . 0.0 113.383 -177.389 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 37.2 tp10 -74.48 -49.13 23.44 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 124.421 1.088 . . . . 0.0 112.195 -179.459 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 20.5 m -77.18 -31.71 55.6 Favored 'General case' 0 N--CA 1.476 0.833 0 O-C-N 121.739 -0.601 . . . . 0.0 111.924 172.637 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 76.38 30.48 56.7 Favored Glycine 0 CA--C 1.535 1.309 0 C-N-CA 123.506 0.574 . . . . 0.0 111.878 -170.11 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 79.9 mm-40 -130.95 175.92 8.67 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 126.253 1.821 . . . . 0.0 111.085 -174.166 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 62.4 m95 -100.15 149.77 23.19 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 123.969 0.908 . . . . 0.0 111.026 172.306 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 13.0 m -140.84 147.05 23.14 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 C-N-CA 125.94 1.696 . . . . 0.0 112.871 -172.311 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 4.1 m0 -97.64 106.64 18.99 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 125.905 1.682 . . . . 0.0 107.891 169.057 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 42.8 mtmt -81.96 153.22 26.37 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 124.133 0.973 . . . . 0.0 112.282 -179.456 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 54.25 33.65 18.66 Favored 'General case' 0 CA--C 1.554 1.101 0 C-N-CA 125.646 1.578 . . . . 0.0 111.601 -174.825 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 65.5 m -130.03 150.86 51.12 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 125.307 1.443 . . . . 0.0 112.293 -169.407 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 9.9 tt -140.24 146.32 24.82 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.653 0 C-N-CA 128.508 2.723 . . . . 0.0 110.108 -179.667 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 67.3 tt0 -113.77 132.87 55.69 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 125.35 1.46 . . . . 0.0 110.689 170.272 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 9.4 p -157.19 143.71 9.71 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 C-N-CA 124.479 1.112 . . . . 0.0 111.411 176.378 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 9.4 t-20 52.78 32.9 13.0 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 125.285 1.434 . . . . 0.0 114.421 178.223 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 76.05 9.76 85.33 Favored Glycine 0 CA--C 1.538 1.489 0 C-N-CA 124.698 1.142 . . . . 0.0 115.563 -177.511 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 99.6 mttt -122.13 152.45 39.88 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 126.013 1.725 . . . . 0.0 111.493 -179.983 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 79.0 m-85 -98.65 150.62 21.57 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 124.084 0.954 . . . . 0.0 112.751 170.304 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 93.4 m-85 -151.44 161.51 42.56 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 125.959 1.704 . . . . 0.0 110.1 -179.681 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 596' ' ' HIS . . . . . 0.437 ' HB2' ' HB2' ' A' ' 599' ' ' CYS . 28.6 m80 -75.71 141.89 42.58 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 167.027 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 50.3 p -61.26 -42.71 99.1 Favored 'General case' 0 N--CA 1.47 0.525 0 C-N-CA 123.592 0.757 . . . . 0.0 112.214 -179.321 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 2.7 p -68.35 -42.0 79.85 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 124.42 1.088 . . . . 0.0 112.791 175.457 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 599' ' ' CYS . . . . . 0.437 ' HB2' ' HB2' ' A' ' 596' ' ' HIS . 69.4 m -58.68 -59.2 5.79 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.192 0.997 . . . . 0.0 110.894 175.068 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 79.2 t80 -57.76 -43.25 85.35 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.375 1.07 . . . . 0.0 112.648 -177.912 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 82.5 t60 -58.13 -39.49 78.85 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 179.855 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 37.9 tp10 -90.45 -25.26 20.43 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 114.241 1.2 . . . . 0.0 114.241 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 28.3 m -110.04 -26.11 9.88 Favored 'General case' 0 N--CA 1.482 1.164 0 N-CA-C 115.766 1.765 . . . . 0.0 115.766 -166.924 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 604' ' ' SER . . . . . . . . . . . . . 71.2 p -56.23 -72.09 0.08 Allowed 'General case' 0 N--CA 1.481 1.098 0 N-CA-C 115.134 1.531 . . . . 0.0 115.134 -168.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 605' ' ' GLN . . . . . . . . . . . . . 37.0 tt0 40.66 -88.93 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 128.532 2.733 . . . . 0.0 116.2 178.689 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 606' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -149.51 147.9 28.75 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 126.281 1.833 . . . . 0.0 112.143 -176.423 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 607' ' ' SER . . . . . . . . . . . . . 33.3 t -73.03 -35.79 66.82 Favored 'General case' 0 N--CA 1.479 0.982 0 N-CA-C 113.349 0.87 . . . . 0.0 113.349 176.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 608' ' ' SER . . . . . . . . . . . . . 64.6 p . . . . . 0 C--O 1.252 1.235 0 C-N-CA 126.285 1.834 . . . . 0.0 113.252 -177.7 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 533' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.614 0 N-CA-C 111.458 -0.657 . . . . 0.0 111.458 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 81.83 23.52 57.55 Favored Glycine 0 CA--C 1.537 1.454 0 C-N-CA 123.977 0.798 . . . . 0.0 113.258 -172.36 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 535' ' ' SER . . . . . . . . . . . . . 79.5 p -145.75 4.29 0.99 Allowed 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 126.119 1.768 . . . . 0.0 113.945 -171.186 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 536' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -64.89 176.29 1.26 Allowed 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 126.311 1.844 . . . . 0.0 113.2 173.095 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 537' ' ' PHE . . . . . . . . . . . . . 40.8 p90 -61.99 -26.95 68.53 Favored 'General case' 0 CA--C 1.546 0.806 0 N-CA-C 113.973 1.101 . . . . 0.0 113.973 177.737 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 65.3 p -78.86 157.81 28.24 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 125.497 1.519 . . . . 0.0 112.913 177.803 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 539' ' ' ASP . . . . . . . . . . . . . 63.8 m-20 -77.65 56.93 1.53 Allowed 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 125.379 1.472 . . . . 0.0 113.732 -173.472 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 540' ' ' ARG . . . . . . . . . . . . . 55.4 mtp180 -72.16 28.42 0.05 Allowed 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 126.322 1.849 . . . . 0.0 114.733 178.914 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 20.8 t -73.62 -175.0 1.88 Allowed 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 125.552 1.541 . . . . 0.0 111.31 170.928 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 542' ' ' ASN . . . . . . . . . . . . . 76.2 m-20 -55.38 -21.84 17.16 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.017 1.327 . . . . 0.0 113.71 176.22 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 85.7 mt-10 -56.12 -26.76 51.32 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 125.08 1.352 . . . . 0.0 113.465 172.154 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 50.2 tp -69.56 -31.6 69.88 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 123.997 0.919 . . . . 0.0 112.689 175.04 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 69.3 mm-40 -75.51 -24.7 56.87 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.468 1.107 . . . . 0.0 112.824 177.728 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 22.7 mm -58.12 -37.02 59.65 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.829 0 C-N-CA 124.391 1.077 . . . . 0.0 111.45 177.513 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 30.7 mmm-85 -64.59 -29.93 70.95 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.739 1.216 . . . . 0.0 112.693 178.564 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -82.54 -7.29 87.7 Favored Glycine 0 CA--C 1.535 1.282 0 C-N-CA 125.056 1.312 . . . . 0.0 115.133 179.9 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -69.99 145.85 51.51 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 118.904 1.352 . . . . 0.0 111.829 176.806 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 38.6 p90 -153.39 166.92 31.15 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 125.032 1.333 . . . . 0.0 112.773 175.296 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 2.4 m -131.1 138.72 52.75 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.5 0 C-N-CA 125.733 1.613 . . . . 0.0 110.136 169.774 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 9.9 p -69.36 136.41 26.32 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 O-C-N 121.319 -0.863 . . . . 0.0 111.623 -176.993 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 51.1 t -76.31 123.89 88.0 Favored Pre-proline 0 CA--C 1.543 0.706 0 C-N-CA 124.805 1.242 . . . . 0.0 109.586 177.352 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -74.9 150.2 38.33 Favored 'Trans proline' 0 CA--C 1.543 0.939 0 C-N-CA 122.993 2.462 . . . . 0.0 111.028 175.998 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 50.3 mt-10 -65.09 -19.29 65.92 Favored 'General case' 0 CA--C 1.549 0.926 0 N-CA-C 113.479 0.918 . . . . 0.0 113.479 177.723 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 68.2 p -68.71 -24.92 64.54 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 124.216 1.006 . . . . 0.0 113.153 170.334 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 17.5 t -79.36 76.55 5.93 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-O 122.371 1.081 . . . . 0.0 110.299 169.791 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 62.6 tt0 -60.33 -34.45 73.84 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.356 1.062 . . . . 0.0 112.956 -174.496 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 69.4 m-20 -87.51 -6.59 58.3 Favored 'General case' 0 CA--C 1.551 0.981 0 C-N-CA 124.954 1.302 . . . . 0.0 113.74 175.114 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 9.0 mtt 52.24 38.44 24.66 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 126.785 2.034 . . . . 0.0 114.188 -178.116 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -128.26 143.43 51.03 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 114.244 1.201 . . . . 0.0 114.244 -173.168 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -143.36 176.54 9.08 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 126.487 1.915 . . . . 0.0 109.322 172.826 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 563' ' ' LYS . . . . . . . . . . . . 0.255 0.0 OUTLIER -141.76 148.16 38.52 Favored 'General case' 0 N--CA 1.477 0.888 0 N-CA-C 114.767 1.395 . . . . 0.0 114.767 175.891 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 12.0 t -79.32 116.85 63.49 Favored Pre-proline 0 CA--C 1.542 0.636 0 C-N-CA 126.765 2.026 . . . . 0.0 111.006 173.451 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_endo -72.51 -18.15 26.12 Favored 'Trans proline' 0 CA--C 1.545 1.073 0 C-N-CA 122.719 2.279 . . . . 0.0 113.612 174.782 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 90.7 mt -71.49 -55.22 14.47 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.9 0 C-N-CA 124.514 1.125 . . . . 0.0 110.747 -178.442 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 13.9 p -103.61 2.52 33.42 Favored 'General case' 0 CA--C 1.552 1.028 0 N-CA-C 114.137 1.162 . . . . 0.0 114.137 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 568' ' ' LYS . . . . . . . . . . . . 0.308 11.9 ptmm? 54.52 46.61 24.52 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 127.04 2.136 . . . . 0.0 113.82 -177.045 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 69.2 mm-40 -124.81 143.33 50.87 Favored 'General case' 0 N--CA 1.482 1.143 0 N-CA-C 114.835 1.42 . . . . 0.0 114.835 -176.108 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 73.9 m -78.06 145.66 35.72 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 124.241 1.017 . . . . 0.0 112.749 -178.589 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -119.61 131.7 71.43 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.892 0 C-N-CA 127.014 2.126 . . . . 0.0 109.752 168.305 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 38.9 p -111.86 147.02 36.67 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 125.064 1.345 . . . . 0.0 111.753 178.277 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -71.02 147.57 43.16 Favored Glycine 0 CA--C 1.532 1.101 0 C-N-CA 124.933 1.254 . . . . 0.0 113.743 178.621 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 60.9 t -139.47 132.49 36.93 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 C-N-CA 124.56 1.144 . . . . 0.0 111.083 -176.465 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 68.5 t80 -70.12 112.1 6.24 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 118.706 0.684 . . . . 0.0 111.522 179.478 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 23.2 t0 -81.8 112.02 18.57 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 123.331 0.653 . . . . 0.0 109.559 169.39 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 53.6 mt-10 -69.43 -19.31 63.79 Favored 'General case' 0 CA--C 1.546 0.812 0 N-CA-C 113.913 1.079 . . . . 0.0 113.913 178.836 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 33.2 tp10 -77.38 -51.41 10.86 Favored 'General case' 0 CA--C 1.543 0.71 0 O-C-N 121.366 -0.834 . . . . 0.0 112.811 178.898 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 32.2 t -76.06 -33.42 59.58 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 124.309 1.044 . . . . 0.0 112.686 172.318 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 86.09 31.18 20.84 Favored Glycine 0 CA--C 1.531 1.064 0 C-N-CA 125.038 1.304 . . . . 0.0 113.63 -176.761 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 74.1 mm-40 -142.31 151.66 42.19 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 125.504 1.522 . . . . 0.0 111.825 -172.459 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 82.5 m95 -75.84 134.4 40.36 Favored 'General case' 0 N--CA 1.468 0.437 0 O-C-N 121.653 -0.654 . . . . 0.0 111.7 172.521 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 17.0 m -135.05 143.0 38.5 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.559 0 C-N-CA 125.414 1.486 . . . . 0.0 113.327 -171.844 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 3.7 m0 -91.03 100.95 13.72 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 126.287 1.835 . . . . 0.0 107.857 169.288 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -73.98 153.85 39.56 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 124.169 0.988 . . . . 0.0 111.66 -179.68 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 54.63 36.75 26.76 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 125.03 1.332 . . . . 0.0 112.047 179.409 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 85.0 m -129.83 148.19 51.68 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 125.173 1.389 . . . . 0.0 112.113 -170.328 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 588' ' ' ILE . . . . . 0.406 HG23 ' HB2' ' A' ' 595' ' ' PHE . 15.4 tt -145.84 146.3 19.46 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 C-N-CA 126.912 2.085 . . . . 0.0 111.503 -178.388 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 8.9 tm-20 -107.54 145.6 32.94 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.852 1.261 . . . . 0.0 111.172 166.343 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 1.2 t -159.32 144.58 6.56 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 C-N-CA 126.196 1.798 . . . . 0.0 109.765 171.589 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 10.6 t-20 54.99 29.87 13.09 Favored 'General case' 0 CA--C 1.554 1.133 0 N-CA-C 114.17 1.174 . . . . 0.0 114.17 175.036 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 76.73 14.06 82.91 Favored Glycine 0 CA--C 1.535 1.284 0 C-N-CA 124.618 1.104 . . . . 0.0 115.066 -176.45 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 51.1 mttp -131.31 146.83 52.46 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 126.088 1.755 . . . . 0.0 110.873 -171.337 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 57.4 m-85 -102.35 147.85 26.2 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 123.857 0.863 . . . . 0.0 112.838 -178.329 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 595' ' ' PHE . . . . . 0.406 ' HB2' HG23 ' A' ' 588' ' ' ILE . 89.8 m-85 -153.19 164.46 38.02 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.914 1.686 . . . . 0.0 111.574 -169.879 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 596' ' ' HIS . . . . . 0.43 ' HB2' ' HB2' ' A' ' 599' ' ' CYS . 17.6 m80 -77.83 140.72 39.4 Favored 'General case' 0 N--CA 1.473 0.694 0 O-C-N 121.023 -1.048 . . . . 0.0 108.706 166.204 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 78.3 p -58.4 -42.24 86.69 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 123.657 0.783 . . . . 0.0 112.234 178.304 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 22.8 p -67.92 -47.71 67.99 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 125.533 1.533 . . . . 0.0 113.213 174.854 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 599' ' ' CYS . . . . . 0.43 ' HB2' ' HB2' ' A' ' 596' ' ' HIS . 86.4 m -60.65 -50.63 72.75 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 123.436 0.694 . . . . 0.0 111.493 179.732 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 88.2 t80 -56.07 -45.22 79.39 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 123.291 0.637 . . . . 0.0 112.135 178.227 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 22.7 t-160 -63.67 -46.56 84.99 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 112.939 0.718 . . . . 0.0 112.939 177.736 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 14.9 tm-20 -70.42 -33.4 71.3 Favored 'General case' 0 CA--C 1.543 0.702 0 O-C-N 121.502 -0.749 . . . . 0.0 112.649 -179.642 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 96.0 m -74.7 -37.53 62.59 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.619 1.168 . . . . 0.0 112.06 177.823 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 604' ' ' SER . . . . . . . . . . . . . 38.0 m -78.06 58.95 2.09 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 125.247 1.419 . . . . 0.0 111.5 174.814 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 605' ' ' GLN . . . . . . . . . . . . . 2.8 pt20 -70.4 75.48 0.55 Allowed 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 126.233 1.813 . . . . 0.0 113.817 -170.318 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 606' ' ' ASN . . . . . . . . . . . . . 65.4 m-20 58.5 31.4 20.97 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 126.529 1.932 . . . . 0.0 114.283 177.231 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 607' ' ' SER . . . . . . . . . . . . . 65.1 p -67.49 154.24 41.85 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 124.904 1.281 . . . . 0.0 113.073 175.056 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 608' ' ' SER . . . . . . . . . . . . . 21.1 t . . . . . 0 C--O 1.253 1.285 0 C-N-CA 125.662 1.585 . . . . 0.0 112.936 -179.255 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 533' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.551 0 N-CA-C 111.842 -0.503 . . . . 0.0 111.842 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 173.82 -162.95 33.88 Favored Glycine 0 CA--C 1.535 1.305 0 C-N-CA 124.71 1.147 . . . . 0.0 113.604 179.485 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 535' ' ' SER . . . . . . . . . . . . . 77.2 p -69.92 174.85 4.84 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.846 1.258 . . . . 0.0 112.62 170.917 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 536' ' ' GLU . . . . . . . . . . . . . 15.0 mp0 -68.24 136.39 53.46 Favored 'General case' 0 CA--C 1.547 0.852 0 O-C-N 120.887 -1.133 . . . . 0.0 113.096 -179.563 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 537' ' ' PHE . . . . . . . . . . . . . 75.7 m-85 -133.61 16.4 3.98 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 125.449 1.5 . . . . 0.0 113.262 177.021 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 88.8 p -153.49 163.73 39.45 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 124.767 1.227 . . . . 0.0 113.288 -172.234 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 539' ' ' ASP . . . . . . . . . . . . . 31.7 m-20 -131.39 149.46 52.53 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 126.948 2.099 . . . . 0.0 109.986 173.027 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 540' ' ' ARG . . . . . . . . . . . . . 13.3 tpt180 -78.3 52.29 1.11 Allowed 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 124.407 1.083 . . . . 0.0 112.801 -178.906 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 49.7 m -68.94 136.2 52.17 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 124.869 1.268 . . . . 0.0 111.282 174.728 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 542' ' ' ASN . . . . . . . . . . . . . 13.3 p-10 -60.58 -26.4 66.92 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 123.955 0.902 . . . . 0.0 113.372 -177.74 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 76.2 mt-10 -62.08 -30.52 71.06 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 125.103 1.361 . . . . 0.0 113.137 176.951 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 63.2 mt -82.03 -26.46 33.76 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.125 0.97 . . . . 0.0 112.274 179.087 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -65.77 -26.43 67.71 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 124.539 1.136 . . . . 0.0 112.51 -179.874 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 14.1 mm -54.43 -34.97 29.64 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 C-N-CA 126.057 1.743 . . . . 0.0 112.451 -177.545 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 32.8 ttm180 -61.33 -21.48 64.04 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 125.158 1.383 . . . . 0.0 113.924 178.051 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -71.85 -12.74 75.04 Favored Glycine 0 CA--C 1.539 1.566 0 N-CA-C 115.289 0.876 . . . . 0.0 115.289 177.271 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -70.96 147.91 48.22 Favored 'General case' 0 N--CA 1.478 0.944 0 CA-C-N 118.965 1.383 . . . . 0.0 112.129 177.844 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 46.8 p90 -152.59 165.81 34.01 Favored 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 114.008 1.114 . . . . 0.0 114.008 176.127 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 1.1 m -135.67 139.5 46.22 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.035 0 C-N-CA 126.757 2.023 . . . . 0.0 110.484 174.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 55.5 t -69.71 133.09 32.46 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.298 0 O-C-N 120.889 -1.132 . . . . 0.0 111.662 -176.021 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 95.0 t -69.37 124.17 89.91 Favored Pre-proline 0 N--CA 1.476 0.837 0 C-N-CA 124.725 1.21 . . . . 0.0 109.035 170.263 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 93.7 Cg_endo -78.35 143.48 19.68 Favored 'Trans proline' 0 CA--C 1.536 0.596 0 C-N-CA 123.152 2.568 . . . . 0.0 111.977 174.477 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -61.55 -24.76 66.86 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.08 0.952 . . . . 0.0 113.248 -179.559 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 58.6 p -72.18 -26.45 62.07 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 124.7 1.2 . . . . 0.0 113.523 177.207 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 39.7 m -80.85 88.94 5.82 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-N 119.336 0.971 . . . . 0.0 110.829 175.01 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 83.4 mt-30 -56.1 -30.97 62.82 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.205 1.402 . . . . 0.0 113.984 -176.694 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 69.4 m-20 -76.87 -21.73 54.51 Favored 'General case' 0 CA--C 1.545 0.784 0 N-CA-C 113.859 1.059 . . . . 0.0 113.859 178.257 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 66.8 mtp 51.3 32.67 8.62 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 126.105 1.762 . . . . 0.0 113.27 -173.488 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -147.97 154.12 39.91 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 124.691 1.196 . . . . 0.0 113.035 -170.346 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 6.9 t80 -153.94 155.64 36.0 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 124.922 1.289 . . . . 0.0 110.502 173.164 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 3.2 tmmm? -106.58 115.4 30.14 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 125.171 1.388 . . . . 0.0 111.985 -173.695 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 35.5 t -54.37 111.38 2.84 Favored Pre-proline 0 CA--C 1.545 0.768 0 C-N-CA 127.596 2.358 . . . . 0.0 111.279 174.876 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -62.74 -21.52 73.08 Favored 'Trans proline' 0 CA--C 1.539 0.755 0 C-N-CA 123.018 2.478 . . . . 0.0 114.957 178.894 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 96.7 mt -74.54 -57.56 6.34 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 C-N-CA 123.965 0.906 . . . . 0.0 111.164 -176.653 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 16.7 p -102.48 -0.94 31.54 Favored 'General case' 0 CA--C 1.551 0.986 0 N-CA-C 113.784 1.031 . . . . 0.0 113.784 -176.76 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 568' ' ' LYS . . . . . . . . . . . . . 32.9 mmtp 61.27 46.4 7.9 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 127.201 2.2 . . . . 0.0 112.985 -176.795 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 75.7 mt-10 -122.3 136.02 54.83 Favored 'General case' 0 N--CA 1.487 1.405 0 N-CA-C 114.737 1.384 . . . . 0.0 114.737 -173.916 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 79.2 m -83.49 116.85 22.73 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 112.896 0.702 . . . . 0.0 112.896 -179.016 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -85.27 147.56 5.43 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 C-N-CA 124.74 1.216 . . . . 0.0 110.116 167.068 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 58.4 p -133.32 151.37 51.87 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 125.636 1.574 . . . . 0.0 111.25 -179.37 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -70.15 158.53 53.5 Favored Glycine 0 CA--C 1.535 1.327 0 N-CA-C 114.965 0.746 . . . . 0.0 114.965 -176.034 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 9.2 p -140.52 143.37 29.26 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 125.099 1.36 . . . . 0.0 111.763 170.128 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 9.2 t80 -75.07 127.13 32.51 Favored 'General case' 0 CA--C 1.549 0.932 0 N-CA-C 113.905 1.076 . . . . 0.0 113.905 -173.922 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 37.7 t0 -97.85 101.19 12.63 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 125.812 1.645 . . . . 0.0 109.494 168.638 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -63.89 -26.61 68.68 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 124.651 1.181 . . . . 0.0 113.454 -179.194 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 73.2 mm-40 -78.03 -46.06 21.97 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 123.664 0.786 . . . . 0.0 112.468 -178.152 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 71.2 m -77.62 -29.36 51.76 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 123.446 0.698 . . . . 0.0 112.33 173.212 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 81.46 26.82 50.12 Favored Glycine 0 CA--C 1.534 1.257 0 C-N-CA 123.957 0.789 . . . . 0.0 112.963 -175.375 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 79.6 mm-40 -137.68 161.18 37.17 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 126.345 1.858 . . . . 0.0 110.148 -173.034 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 32.6 m95 -96.35 150.26 20.77 Favored 'General case' 0 CA--C 1.54 0.59 0 O-C-N 120.941 -1.1 . . . . 0.0 111.569 175.795 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 9.9 m -135.6 144.9 32.54 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 C-N-CA 125.299 1.44 . . . . 0.0 113.115 -173.686 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 3.2 m0 -92.0 104.86 17.22 Favored 'General case' 0 C--O 1.234 0.276 0 C-N-CA 126.67 1.988 . . . . 0.0 109.411 170.035 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -73.76 152.53 40.32 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 124.679 1.192 . . . . 0.0 112.104 178.421 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 54.73 29.86 12.49 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 125.519 1.527 . . . . 0.0 112.433 -177.662 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 62.0 m -125.05 149.22 48.01 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 124.517 1.127 . . . . 0.0 112.797 -169.303 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 14.9 tt -136.14 145.48 30.83 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.585 0 C-N-CA 127.906 2.482 . . . . 0.0 110.373 177.516 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 71.3 tt0 -107.77 123.48 48.61 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.659 1.184 . . . . 0.0 109.618 169.723 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 7.6 p -157.56 146.27 10.12 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 C-N-CA 124.774 1.23 . . . . 0.0 110.518 -177.028 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 8.2 t-20 52.88 35.19 18.36 Favored 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 124.642 1.177 . . . . 0.0 112.894 -175.649 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 68.67 14.39 67.29 Favored Glycine 0 CA--C 1.536 1.35 0 C-N-CA 125.5 1.524 . . . . 0.0 115.661 -178.291 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 35.9 mtmm -133.31 156.89 46.77 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 125.937 1.695 . . . . 0.0 111.456 -175.671 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 85.8 m-85 -90.74 147.26 23.36 Favored 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 113.001 0.741 . . . . 0.0 113.001 172.588 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 78.4 m-85 -150.44 160.72 43.56 Favored 'General case' 0 C--N 1.329 -0.326 0 C-N-CA 126.235 1.814 . . . . 0.0 110.043 -175.612 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 596' ' ' HIS . . . . . . . . . . . . . 26.0 m80 -75.2 139.08 42.4 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 108.486 -0.931 . . . . 0.0 108.486 167.136 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 59.2 p -59.91 -40.16 87.86 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.634 0.774 . . . . 0.0 111.812 177.653 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 9.4 p -71.25 -36.83 71.92 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 125.693 1.597 . . . . 0.0 113.113 176.72 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 599' ' ' CYS . . . . . . . . . . . . . 69.2 m -64.75 -59.48 4.18 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.353 1.061 . . . . 0.0 111.186 174.795 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 61.7 t80 -53.3 -41.51 65.7 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.363 1.065 . . . . 0.0 113.069 -177.179 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 83.2 t60 -61.4 -34.2 74.95 Favored 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 114.879 1.437 . . . . 0.0 114.879 -177.476 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 35.1 tp10 -102.22 -18.75 15.36 Favored 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 114.196 1.184 . . . . 0.0 114.196 -176.277 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 50.1 m -77.34 -32.01 54.85 Favored 'General case' 0 N--CA 1.481 1.09 0 N-CA-C 115.993 1.849 . . . . 0.0 115.993 -167.977 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 604' ' ' SER . . . . . . . . . . . . . 26.6 t -64.48 123.17 18.53 Favored 'General case' 0 N--CA 1.477 0.918 0 CA-C-N 119.789 1.177 . . . . 0.0 113.186 -173.103 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 605' ' ' GLN . . . . . . . . . . . . . 66.2 mt-30 -97.96 -27.37 14.28 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 124.58 1.152 . . . . 0.0 113.671 -178.251 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 606' ' ' ASN . . . . . . . . . . . . . 14.9 t-20 -83.88 171.18 13.31 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 124.789 1.236 . . . . 0.0 112.459 -174.242 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 607' ' ' SER . . . . . . . . . . . . . 19.3 m 59.25 34.19 22.95 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 125.693 1.597 . . . . 0.0 114.063 176.413 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 608' ' ' SER . . . . . . . . . . . . . 22.8 t . . . . . 0 C--O 1.254 1.317 0 C-N-CA 125.453 1.501 . . . . 0.0 112.551 176.624 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 533' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.626 0 N-CA-C 112.241 -0.344 . . . . 0.0 112.241 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . 80.57 4.42 90.15 Favored Glycine 0 CA--C 1.539 1.578 0 C-N-CA 124.788 1.185 . . . . 0.0 115.649 179.14 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 535' ' ' SER . . . . . . . . . . . . . 26.7 m -76.1 58.4 1.21 Allowed 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 126.279 1.831 . . . . 0.0 112.339 179.05 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 536' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -143.36 153.75 43.03 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 125.198 1.399 . . . . 0.0 112.562 -173.125 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 537' ' ' PHE . . . . . . . . . . . . . 86.1 m-85 -75.99 153.2 36.7 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.389 1.076 . . . . 0.0 112.944 178.921 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 14.1 t -158.59 -174.92 5.02 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 126.027 1.731 . . . . 0.0 110.751 -178.599 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 539' ' ' ASP . . . . . . . . . . . . . 68.8 m-20 -70.53 3.11 3.28 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 125.583 1.553 . . . . 0.0 114.194 174.771 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 540' ' ' ARG . . . . . . . . . . . . . 3.1 ttp180 -70.79 66.05 0.35 Allowed 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 127.435 2.294 . . . . 0.0 113.056 179.258 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 17.0 t -74.23 -145.72 0.02 OUTLIER 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 125.97 1.708 . . . . 0.0 110.865 170.618 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 542' ' ' ASN . . . . . . . . . . . . . 40.2 p-10 -65.28 11.53 0.06 Allowed 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 126.082 1.753 . . . . 0.0 115.409 174.031 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 8.9 mm-40 -51.22 -41.33 60.22 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 126.37 1.868 . . . . 0.0 112.75 179.448 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 11.0 mp -62.15 -33.81 75.2 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 124.152 0.981 . . . . 0.0 111.86 179.032 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 32.6 tp10 -82.6 -36.67 25.95 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 123.541 0.736 . . . . 0.0 112.689 179.929 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 30.0 mm -64.86 -41.61 92.62 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 C-N-CA 123.349 0.66 . . . . 0.0 110.891 172.256 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 71.4 mtp180 -85.68 -20.8 28.84 Favored 'General case' 0 N--CA 1.481 1.1 0 N-CA-C 113.389 0.885 . . . . 0.0 113.389 -175.279 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -72.63 -10.97 76.92 Favored Glycine 0 CA--C 1.54 1.626 0 C-N-CA 125.467 1.508 . . . . 0.0 114.466 171.686 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 70.1 mmtt -66.34 140.12 58.07 Favored 'General case' 0 N--CA 1.477 0.918 0 CA-C-N 119.089 1.444 . . . . 0.0 111.747 173.271 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 46.1 p90 -153.79 164.86 37.64 Favored 'General case' 0 C--O 1.238 0.467 0 C-N-CA 124.253 1.021 . . . . 0.0 111.723 169.613 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -134.37 135.33 54.21 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 C-N-CA 125.563 1.545 . . . . 0.0 109.736 175.045 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 53.9 t -67.95 133.07 32.21 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.104 0 C-N-CA 123.741 0.816 . . . . 0.0 110.731 -177.349 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 553' ' ' VAL . . . . . 0.451 HG22 ' CD2' ' A' ' 584' ' ' TRP . 5.3 t -84.92 116.17 64.21 Favored Pre-proline 0 CA--C 1.541 0.61 0 C-N-CA 124.117 0.967 . . . . 0.0 109.84 173.805 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -76.69 163.33 31.76 Favored 'Trans proline' 0 CA--C 1.536 0.623 0 C-N-CA 122.509 2.139 . . . . 0.0 112.162 176.887 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 39.8 mm-40 -62.38 -28.64 69.91 Favored 'General case' 0 CA--C 1.548 0.895 0 O-C-N 121.296 -0.878 . . . . 0.0 112.562 173.04 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 69.7 p -67.59 -18.0 64.84 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 125.038 1.335 . . . . 0.0 113.322 175.793 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 18.2 m -80.81 -0.6 39.46 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 114.335 1.235 . . . . 0.0 114.335 169.684 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 88.4 mt-30 45.36 -84.43 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 128.571 2.748 . . . . 0.0 116.621 169.268 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 71.1 m-20 -70.83 -9.35 57.35 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 125.446 1.498 . . . . 0.0 113.914 178.738 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 12.1 mtt 57.99 31.14 20.23 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 126.002 1.721 . . . . 0.0 115.043 178.024 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -122.56 141.84 51.25 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 124.024 0.93 . . . . 0.0 112.943 -177.401 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -149.59 157.84 43.62 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 124.979 1.312 . . . . 0.0 111.436 179.703 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 39.2 ttpt -104.11 144.95 30.88 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 124.795 1.238 . . . . 0.0 114.197 -170.553 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 12.2 t -100.63 107.21 47.64 Favored Pre-proline 0 CA--C 1.541 0.632 0 C-N-CA 126.833 2.053 . . . . 0.0 108.607 166.943 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo -69.96 -16.96 36.91 Favored 'Trans proline' 0 CA--C 1.546 1.097 0 C-N-CA 122.502 2.134 . . . . 0.0 113.443 177.53 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 87.6 mt -72.9 -57.78 6.3 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 C-N-CA 124.12 0.968 . . . . 0.0 111.13 -178.957 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 15.5 p -98.11 -1.93 41.22 Favored 'General case' 0 CA--C 1.552 1.022 0 N-CA-C 113.648 0.981 . . . . 0.0 113.648 179.697 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 568' ' ' LYS . . . . . . . . . . . . . 45.6 tttt 59.73 45.84 12.37 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 126.522 1.929 . . . . 0.0 112.705 -177.736 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 70.3 mm-40 -117.59 166.09 12.79 Favored 'General case' 0 N--CA 1.482 1.149 0 N-CA-C 112.83 0.678 . . . . 0.0 112.83 -178.688 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 89.7 m -112.2 118.53 35.57 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.972 0.909 . . . . 0.0 111.199 179.34 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 3.5 m -79.53 138.58 19.71 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 123.486 0.715 . . . . 0.0 110.26 167.721 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 41.4 p -120.99 142.56 49.67 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 124.818 1.247 . . . . 0.0 110.077 176.307 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -65.92 144.15 46.15 Favored Glycine 0 CA--C 1.533 1.18 0 O-C-N 122.067 -0.395 . . . . 0.0 112.804 178.788 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 86.4 t -129.24 131.95 67.25 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 C-N-CA 125.237 1.415 . . . . 0.0 110.938 -178.901 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 71.5 t80 -71.82 117.49 13.48 Favored 'General case' 0 CA--C 1.549 0.912 0 CA-C-N 118.622 0.647 . . . . 0.0 112.315 -178.395 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 39.7 t0 -84.45 111.01 19.09 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.534 1.134 . . . . 0.0 109.469 169.016 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 54.5 mt-10 -68.9 -24.16 64.28 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 113.672 0.99 . . . . 0.0 113.672 -179.22 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 61.0 mt-10 -77.32 -42.0 38.43 Favored 'General case' 0 N--CA 1.475 0.788 0 O-C-N 121.207 -0.933 . . . . 0.0 112.908 -176.166 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 96.8 p -91.34 -24.74 19.7 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.852 0.861 . . . . 0.0 113.092 172.366 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 82.05 32.16 29.94 Favored Glycine 0 CA--C 1.533 1.159 0 C-N-CA 124.228 0.918 . . . . 0.0 113.124 -178.61 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 61.4 mm-40 -134.49 149.55 50.71 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 125.189 1.396 . . . . 0.0 111.439 -173.881 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 78.4 m95 -79.62 141.7 36.28 Favored 'General case' 0 CA--C 1.535 0.402 0 O-C-N 121.22 -0.925 . . . . 0.0 111.257 171.668 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 21.1 m -137.01 143.85 33.74 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 C-N-CA 125.703 1.601 . . . . 0.0 113.124 -174.973 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 584' ' ' TRP . . . . . 0.451 ' CD2' HG22 ' A' ' 553' ' ' VAL . 2.2 m0 -95.64 102.27 14.05 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 126.561 1.944 . . . . 0.0 107.739 170.37 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -79.32 148.75 31.98 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.873 1.269 . . . . 0.0 112.224 -176.873 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 61.0 t30 52.41 36.27 19.56 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.759 1.624 . . . . 0.0 112.805 -173.174 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 86.4 m -119.55 147.67 44.19 Favored 'General case' 0 N--CA 1.479 0.982 0 O-C-N 120.739 -1.226 . . . . 0.0 112.064 -172.589 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 8.9 tt -145.16 145.49 20.71 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.586 0 C-N-CA 127.312 2.245 . . . . 0.0 110.78 -177.123 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 63.0 tt0 -113.39 128.83 56.59 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.867 1.267 . . . . 0.0 109.417 168.009 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 7.5 p -152.52 135.9 7.8 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.832 0 C-N-CA 125.35 1.46 . . . . 0.0 110.636 -178.058 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 72.4 m-20 53.99 34.01 18.75 Favored 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 124.868 1.267 . . . . 0.0 113.756 -176.129 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 78.02 11.87 84.95 Favored Glycine 0 CA--C 1.537 1.465 0 C-N-CA 124.985 1.279 . . . . 0.0 115.484 -179.899 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -129.86 150.76 51.01 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 125.311 1.444 . . . . 0.0 111.559 -178.528 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 14.2 m-85 -93.48 147.21 23.18 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.611 1.165 . . . . 0.0 112.238 177.749 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 95.3 m-85 -154.08 165.08 37.31 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 126.027 1.731 . . . . 0.0 111.176 -177.248 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 596' ' ' HIS . . . . . 0.431 ' HB2' ' HB2' ' A' ' 599' ' ' CYS . 21.5 m80 -79.32 142.45 36.08 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 108.142 -1.058 . . . . 0.0 108.142 165.424 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 7.8 t -66.56 -39.06 88.33 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 118.997 0.817 . . . . 0.0 112.012 -178.144 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 21.7 p -63.4 -44.53 94.38 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.109 0.963 . . . . 0.0 112.974 171.781 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 599' ' ' CYS . . . . . 0.431 ' HB2' ' HB2' ' A' ' 596' ' ' HIS . 93.1 m -62.32 -50.96 69.56 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.042 0.937 . . . . 0.0 111.044 177.367 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 56.9 t80 -57.37 -43.75 83.84 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 123.778 0.831 . . . . 0.0 111.889 176.517 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 84.4 t60 -62.55 -40.76 97.86 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 123.64 0.776 . . . . 0.0 112.718 178.454 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 73.3 mm-40 -69.28 -36.86 77.52 Favored 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 113.46 0.911 . . . . 0.0 113.46 173.496 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 71.4 m -77.22 -45.18 27.39 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 124.077 0.951 . . . . 0.0 112.369 -176.883 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 604' ' ' SER . . . . . . . . . . . . . 8.3 t -81.02 55.92 2.63 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.603 1.561 . . . . 0.0 111.513 177.737 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 605' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.2 150.23 49.1 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 124.443 1.097 . . . . 0.0 113.094 -175.416 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 606' ' ' ASN . . . . . . . . . . . . . 58.7 t30 54.32 -91.92 0.03 OUTLIER 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 126.78 2.032 . . . . 0.0 113.79 -176.414 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 607' ' ' SER . . . . . . . . . . . . . 27.3 t -156.76 141.43 16.87 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 125.679 1.592 . . . . 0.0 111.136 177.834 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 608' ' ' SER . . . . . . . . . . . . . 49.7 p . . . . . 0 C--O 1.255 1.347 0 C-N-CA 125.813 1.645 . . . . 0.0 114.059 -178.477 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 533' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.621 0 N-CA-C 111.637 -0.585 . . . . 0.0 111.637 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . -72.17 137.02 24.54 Favored Glycine 0 CA--C 1.536 1.403 0 C-N-CA 124.083 0.849 . . . . 0.0 113.443 179.909 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 535' ' ' SER . . . . . . . . . . . . . 35.5 m -72.59 146.05 46.95 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 124.955 1.302 . . . . 0.0 112.994 179.611 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 536' ' ' GLU . . . . . . . . . . . . . 46.7 tt0 -82.49 84.34 7.24 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.253 1.021 . . . . 0.0 110.997 172.48 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 537' ' ' PHE . . . . . . . . . . . . . 63.9 t80 -74.55 161.32 29.85 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 124.896 1.278 . . . . 0.0 112.721 178.846 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 77.6 p -142.3 140.67 32.25 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 125.326 1.45 . . . . 0.0 112.222 177.877 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 539' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 -73.34 148.54 43.37 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.777 1.231 . . . . 0.0 113.891 -175.246 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 540' ' ' ARG . . . . . . . . . . . . . 31.1 mmm180 -89.72 -39.6 13.06 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 124.779 1.232 . . . . 0.0 112.992 175.281 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 43.4 t -165.0 153.02 11.64 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 125.358 1.463 . . . . 0.0 112.418 -173.304 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 542' ' ' ASN . . . . . . . . . . . . . 8.5 p-10 -65.3 -14.24 60.31 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 124.113 0.965 . . . . 0.0 113.003 169.209 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 -68.11 -19.67 64.86 Favored 'General case' 0 CA--C 1.543 0.685 0 O-C-N 120.717 -1.24 . . . . 0.0 113.358 172.748 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 81.9 mt -72.43 -38.04 68.45 Favored 'General case' 0 N--CA 1.471 0.598 0 O-C-N 121.356 -0.84 . . . . 0.0 111.654 170.05 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 47.6 tp10 -68.52 -15.18 63.45 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 125.401 1.48 . . . . 0.0 113.31 -177.966 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 23.3 mm -56.56 -41.6 73.73 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 C-N-CA 125.165 1.386 . . . . 0.0 111.173 173.568 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 21.2 mmt85 -65.54 -36.65 84.42 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 124.526 1.131 . . . . 0.0 112.321 176.682 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -68.4 -14.27 66.47 Favored Glycine 0 CA--C 1.528 0.901 0 C-N-CA 126.215 1.864 . . . . 0.0 114.278 -179.886 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 65.7 mmtt -76.6 95.26 3.9 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 118.731 1.265 . . . . 0.0 108.659 168.799 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 30.9 p90 -105.91 162.0 13.96 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 113.736 -1.575 . . . . 0.0 111.814 170.353 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 4.3 m -127.85 142.25 44.21 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.617 0 C-N-CA 125.912 1.685 . . . . 0.0 109.803 172.042 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 94.5 t -69.19 135.32 28.59 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 O-C-N 121.606 -0.684 . . . . 0.0 110.742 -176.656 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 97.5 t -68.98 119.73 71.67 Favored Pre-proline 0 CA--C 1.545 0.752 0 C-N-CA 124.04 0.936 . . . . 0.0 108.985 173.283 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo -76.21 154.67 37.07 Favored 'Trans proline' 0 CA--C 1.535 0.568 0 C-N-CA 123.189 2.593 . . . . 0.0 112.472 -177.556 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 17.3 pt-20 -65.3 -17.29 64.39 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 113.199 0.814 . . . . 0.0 113.199 173.779 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 77.4 p -73.09 -22.39 60.58 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.113 0.965 . . . . 0.0 113.005 173.807 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 30.5 t -79.2 110.38 14.41 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 119.281 0.946 . . . . 0.0 110.889 173.578 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 26.5 mp0 -71.95 -31.11 66.0 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.208 1.003 . . . . 0.0 112.53 -178.635 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 66.6 m-20 -108.71 -2.8 18.36 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 125.508 1.523 . . . . 0.0 113.998 -174.793 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 7.4 mtt 55.22 37.53 29.04 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.524 1.53 . . . . 0.0 112.889 -171.718 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -133.02 142.19 48.68 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.312 1.045 . . . . 0.0 113.292 -173.338 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 28.0 t80 -152.63 159.76 43.2 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 125.799 1.64 . . . . 0.0 109.789 174.09 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 38.8 ttmt -118.16 134.71 54.75 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 124.583 1.153 . . . . 0.0 113.737 -170.429 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 19.6 t -73.03 116.78 53.96 Favored Pre-proline 0 CA--C 1.541 0.617 0 C-N-CA 126.104 1.762 . . . . 0.0 110.509 169.308 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 93.2 Cg_endo -71.77 -18.04 28.8 Favored 'Trans proline' 0 CA--C 1.543 0.951 0 C-N-CA 122.892 2.394 . . . . 0.0 113.974 173.315 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 73.6 mt -72.04 -56.67 9.37 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 C-N-CA 123.948 0.899 . . . . 0.0 110.413 -177.456 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 15.6 p -100.99 -0.67 36.11 Favored 'General case' 0 CA--C 1.552 1.055 0 N-CA-C 113.911 1.078 . . . . 0.0 113.911 178.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 568' ' ' LYS . . . . . . . . . . . . . 33.6 tttt 63.73 39.61 8.42 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 126.644 1.978 . . . . 0.0 113.824 -179.041 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 78.6 mm-40 -123.59 138.49 54.54 Favored 'General case' 0 N--CA 1.481 1.099 0 N-CA-C 114.136 1.161 . . . . 0.0 114.136 -171.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 80.5 m -83.64 122.48 28.66 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 124.589 1.155 . . . . 0.0 112.42 -179.28 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 1.7 t -79.33 141.49 15.29 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 C-N-CA 124.715 1.206 . . . . 0.0 109.223 168.106 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 43.1 p -113.66 138.72 49.81 Favored 'General case' 0 N--CA 1.475 0.825 0 C-N-CA 124.67 1.188 . . . . 0.0 109.997 169.28 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -65.97 150.8 51.94 Favored Glycine 0 CA--C 1.535 1.287 0 C-N-CA 124.756 1.169 . . . . 0.0 113.756 -178.44 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 84.3 t -138.05 133.7 44.31 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.858 0 C-N-CA 125.747 1.619 . . . . 0.0 111.598 -176.291 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 70.2 t80 -69.27 141.75 54.29 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-N 119.742 1.156 . . . . 0.0 113.039 179.067 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -126.6 130.64 50.9 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.543 1.137 . . . . 0.0 111.445 172.788 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 80.9 mt-10 -71.72 -25.79 62.22 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 113.541 0.941 . . . . 0.0 113.541 176.848 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -74.23 -42.13 60.23 Favored 'General case' 0 N--CA 1.479 1.023 0 CA-C-N 118.98 0.809 . . . . 0.0 111.481 177.859 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 33.1 m -75.11 -31.57 61.17 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 124.302 1.041 . . . . 0.0 112.029 171.037 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 71.39 22.25 78.59 Favored Glycine 0 CA--C 1.534 1.226 0 C-N-CA 123.959 0.79 . . . . 0.0 112.265 -169.74 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -153.82 166.95 31.29 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 126.382 1.873 . . . . 0.0 112.13 -169.406 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 70.2 m95 -76.69 142.99 40.34 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.728 1.211 . . . . 0.0 111.893 175.718 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 28.9 m -139.74 148.09 23.4 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 C-N-CA 126.663 1.985 . . . . 0.0 112.086 -172.906 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 4.7 m0 -97.71 98.98 10.33 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 127.386 2.275 . . . . 0.0 107.598 170.851 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 66.3 mttm -75.22 154.4 37.57 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 124.412 1.085 . . . . 0.0 111.525 179.808 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 62.1 t30 49.59 40.23 19.0 Favored 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 125.087 1.355 . . . . 0.0 112.411 -174.509 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 96.8 m -130.12 137.94 50.41 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 124.835 1.254 . . . . 0.0 111.383 -175.921 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 11.1 tt -133.75 140.13 47.2 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 C-N-CA 126.363 1.865 . . . . 0.0 112.121 -168.989 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 69.2 tt0 -97.51 132.34 43.29 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.502 1.121 . . . . 0.0 110.621 169.863 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 7.7 p -145.79 127.57 8.35 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.616 0 C-N-CA 125.352 1.461 . . . . 0.0 111.02 171.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 61.9 m-20 53.3 36.81 23.75 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 124.993 1.317 . . . . 0.0 113.828 175.372 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 79.67 8.5 87.67 Favored Glycine 0 CA--C 1.539 1.575 0 C-N-CA 124.67 1.129 . . . . 0.0 115.383 -179.368 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 58.9 mtmt -123.5 160.69 26.41 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 126.29 1.836 . . . . 0.0 111.114 178.247 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 75.3 m-85 -113.27 143.19 44.84 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 124.177 0.991 . . . . 0.0 113.635 179.832 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 21.5 m-30 -139.93 171.82 13.66 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 128.247 2.619 . . . . 0.0 109.77 179.709 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 596' ' ' HIS . . . . . 0.435 ' HB2' ' HB2' ' A' ' 599' ' ' CYS . 20.0 m80 -83.79 143.05 30.22 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 107.976 -1.12 . . . . 0.0 107.976 166.409 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 11.3 m -65.26 -41.35 94.35 Favored 'General case' 0 N--CA 1.473 0.68 0 O-C-N 122.089 -0.382 . . . . 0.0 111.897 -176.72 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 21.3 p -65.55 -42.01 92.36 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-O 118.561 -0.733 . . . . 0.0 112.843 171.84 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 599' ' ' CYS . . . . . 0.435 ' HB2' ' HB2' ' A' ' 596' ' ' HIS . 67.4 m -59.83 -54.02 51.17 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 119.301 0.955 . . . . 0.0 111.605 178.883 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -54.73 -51.83 64.4 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 123.246 0.618 . . . . 0.0 109.929 175.093 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 85.8 t60 -56.71 -45.86 81.61 Favored 'General case' 0 N--CA 1.47 0.542 0 N-CA-C 114.222 1.193 . . . . 0.0 114.222 -179.607 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -80.49 -26.91 37.92 Favored 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 113.946 1.091 . . . . 0.0 113.946 -179.176 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 93.0 m -84.3 -33.73 23.89 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.936 0.895 . . . . 0.0 112.109 -177.854 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 604' ' ' SER . . . . . . . . . . . . . 11.1 t -144.8 71.17 1.29 Allowed 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 124.819 1.248 . . . . 0.0 110.811 -176.522 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 605' ' ' GLN . . . . . . . . . . . . . 52.7 tt0 -70.91 -31.22 67.78 Favored 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 123.88 0.872 . . . . 0.0 112.354 177.118 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 606' ' ' ASN . . . . . . . . . . . . . 62.2 t30 -70.65 154.01 42.28 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 125.258 1.423 . . . . 0.0 112.071 173.799 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 607' ' ' SER . . . . . . . . . . . . . 49.2 m -126.39 148.17 49.65 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 124.978 1.311 . . . . 0.0 112.853 -177.09 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 608' ' ' SER . . . . . . . . . . . . . 6.7 t . . . . . 0 C--O 1.254 1.328 0 C-N-CA 127.824 2.45 . . . . 0.0 114.068 -177.616 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 533' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.629 0 N-CA-C 112.078 -0.409 . . . . 0.0 112.078 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . -72.25 164.48 54.45 Favored Glycine 0 CA--C 1.538 1.516 0 C-N-CA 124.332 0.967 . . . . 0.0 114.158 177.317 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 535' ' ' SER . . . . . . . . . . . . . 80.8 p -153.49 153.77 33.08 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 125.225 1.41 . . . . 0.0 112.316 -179.128 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 536' ' ' GLU . . . . . . . . . . . . . 24.5 mp0 -77.85 151.71 33.76 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.392 1.077 . . . . 0.0 112.084 175.288 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 537' ' ' PHE . . . . . . . . . . . . . 3.3 t80 -82.86 10.43 7.79 Favored 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 125.18 1.392 . . . . 0.0 113.59 -179.917 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 18.9 m -62.46 130.78 46.74 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 125.386 1.474 . . . . 0.0 113.071 -173.368 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 539' ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -74.38 149.45 40.52 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.202 1.401 . . . . 0.0 113.95 -173.526 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 540' ' ' ARG . . . . . . . . . . . . . 10.6 mpt_? -116.11 167.97 10.52 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 126.644 1.978 . . . . 0.0 111.731 177.362 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 23.4 t -61.1 -31.49 71.18 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 124.839 1.255 . . . . 0.0 114.14 -177.297 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 542' ' ' ASN . . . . . . . . . . . . . 5.4 p-10 -144.42 151.6 39.46 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.847 1.659 . . . . 0.0 110.941 174.427 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 31.2 tp10 -91.56 -65.42 1.01 Allowed 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 123.791 0.836 . . . . 0.0 112.874 -174.867 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -155.65 -8.5 0.12 Allowed 'General case' 0 N--CA 1.48 1.073 0 N-CA-C 116.861 2.171 . . . . 0.0 116.861 -174.618 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -60.23 -22.02 62.52 Favored 'General case' 0 N--CA 1.478 0.936 0 N-CA-C 116.001 1.852 . . . . 0.0 116.001 -168.061 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 22.3 mm -52.66 -42.06 39.77 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 C-N-CA 124.968 1.307 . . . . 0.0 113.032 -173.111 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 23.4 ptt180 -72.11 -17.79 61.95 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 113.661 0.986 . . . . 0.0 113.661 -176.625 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -75.62 -11.39 84.47 Favored Glycine 0 CA--C 1.535 1.33 0 C-N-CA 124.856 1.217 . . . . 0.0 114.165 -178.071 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -70.56 131.69 44.37 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 118.565 1.182 . . . . 0.0 110.732 174.766 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 50.0 p90 -140.58 163.94 31.51 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 124.79 1.236 . . . . 0.0 111.967 174.624 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 21.3 m -127.92 143.29 41.28 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 C-N-CA 126.004 1.721 . . . . 0.0 109.733 172.689 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 92.3 t -69.67 134.61 29.84 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.149 0 O-C-N 120.662 -1.274 . . . . 0.0 109.747 175.644 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 85.7 t -63.27 122.96 78.83 Favored Pre-proline 0 CA--C 1.544 0.746 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 179.137 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -72.85 151.07 50.61 Favored 'Trans proline' 0 CA--C 1.538 0.681 0 C-N-CA 122.572 2.182 . . . . 0.0 112.684 -175.595 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 16.0 pt-20 -62.61 -21.01 65.32 Favored 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 113.87 1.063 . . . . 0.0 113.87 179.359 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 45.8 p -74.68 -30.18 61.48 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 125.629 1.572 . . . . 0.0 113.208 176.014 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 62.3 m -87.19 79.76 8.49 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 123.617 0.767 . . . . 0.0 112.006 -177.911 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 85.9 mt-30 -58.4 -32.97 69.13 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 125.138 1.375 . . . . 0.0 113.501 -177.702 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 16.6 t0 -77.65 -12.47 59.97 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 124.764 1.226 . . . . 0.0 113.297 176.604 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 6.5 mtt 52.75 35.99 20.02 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 126.135 1.774 . . . . 0.0 113.364 -175.978 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -142.05 149.73 40.33 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.364 1.065 . . . . 0.0 112.47 -178.221 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 9.3 t80 -153.32 155.24 36.12 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 124.01 0.924 . . . . 0.0 110.825 177.329 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 28.3 ttpp -99.85 134.31 42.95 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 123.969 0.908 . . . . 0.0 113.27 -175.47 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 40.7 t -76.27 116.13 53.34 Favored Pre-proline 0 CA--C 1.541 0.614 0 C-N-CA 127.006 2.122 . . . . 0.0 110.622 169.286 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -62.66 -28.31 76.67 Favored 'Trans proline' 0 CA--C 1.542 0.901 0 C-N-CA 122.708 2.272 . . . . 0.0 114.597 175.686 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 87.3 mt -70.6 -60.47 2.41 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.2 0 CA-C-N 118.845 0.748 . . . . 0.0 111.427 -174.54 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 15.6 p -93.72 -1.99 54.39 Favored 'General case' 0 CA--C 1.549 0.929 0 N-CA-C 113.596 0.961 . . . . 0.0 113.596 179.837 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 568' ' ' LYS . . . . . . . . . . . . . 2.2 mptp? 60.48 43.47 13.06 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 126.959 2.104 . . . . 0.0 112.205 -177.417 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 75.0 mm-40 -123.31 140.73 52.71 Favored 'General case' 0 N--CA 1.482 1.134 0 N-CA-C 114.401 1.26 . . . . 0.0 114.401 -173.645 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 97.5 m -82.06 116.74 21.79 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 123.863 0.865 . . . . 0.0 111.817 179.078 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 2.9 p -79.56 149.47 5.36 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.885 0 C-N-CA 124.411 1.084 . . . . 0.0 110.076 167.949 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 44.5 p -126.07 142.8 51.37 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 124.816 1.246 . . . . 0.0 111.319 -179.376 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -72.81 147.11 39.48 Favored Glycine 0 CA--C 1.529 0.932 0 C-N-CA 124.758 1.171 . . . . 0.0 112.893 -178.291 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 62.5 t -135.09 130.23 51.47 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.421 0 C-N-CA 124.583 1.153 . . . . 0.0 111.749 -178.979 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 68.5 t80 -68.39 115.78 8.21 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 122.993 0.517 . . . . 0.0 112.078 178.354 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 37.2 t0 -86.44 119.4 26.66 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 123.89 0.876 . . . . 0.0 110.006 169.386 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 63.7 mt-10 -69.25 -23.1 63.81 Favored 'General case' 0 CA--C 1.548 0.869 0 N-CA-C 113.2 0.815 . . . . 0.0 113.2 177.18 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 8.4 tm-20 -79.78 -47.76 14.69 Favored 'General case' 0 CA--C 1.541 0.61 0 O-C-N 121.211 -0.931 . . . . 0.0 111.724 -179.38 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 47.7 m -71.94 -28.42 63.45 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.775 0.83 . . . . 0.0 112.379 169.953 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 75.21 24.27 71.71 Favored Glycine 0 CA--C 1.533 1.212 0 C-N-CA 124.686 1.136 . . . . 0.0 113.933 -173.538 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -148.13 159.86 43.49 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 125.983 1.713 . . . . 0.0 111.812 -170.791 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 73.7 m95 -76.87 139.69 40.34 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 123.922 0.889 . . . . 0.0 111.731 -179.894 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 16.8 m -132.87 150.43 32.95 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 126.039 1.736 . . . . 0.0 112.591 -179.181 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 7.8 m0 -100.15 101.43 12.47 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 127.409 2.283 . . . . 0.0 107.829 173.079 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 73.8 mmtt -70.71 151.75 44.57 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 124.986 1.314 . . . . 0.0 111.56 -178.688 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 59.4 t30 49.57 40.4 19.3 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 125.442 1.497 . . . . 0.0 112.962 -177.862 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 99.9 m -123.86 147.74 47.37 Favored 'General case' 0 N--CA 1.485 1.309 0 O-C-N 121.005 -1.06 . . . . 0.0 112.476 -171.232 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 16.4 tt -142.55 148.73 19.67 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.631 0 C-N-CA 127.75 2.42 . . . . 0.0 110.049 -178.169 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 69.5 tt0 -108.34 130.47 55.2 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.421 1.088 . . . . 0.0 110.784 170.294 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 9.4 p -153.31 145.47 14.79 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.911 0 C-N-CA 125.06 1.344 . . . . 0.0 110.503 177.069 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 8.1 t-20 53.59 30.94 11.62 Favored 'General case' 0 CA--C 1.552 1.028 0 C-N-CA 124.944 1.297 . . . . 0.0 113.571 -177.655 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 76.6 11.22 85.43 Favored Glycine 0 CA--C 1.539 1.585 0 C-N-CA 124.976 1.274 . . . . 0.0 115.916 -179.323 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -135.25 161.03 36.55 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 125.914 1.686 . . . . 0.0 112.365 -179.75 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 69.6 m-85 -90.05 150.24 22.18 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 113.684 0.994 . . . . 0.0 113.684 178.258 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 89.1 m-85 -149.94 163.28 38.51 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 127.382 2.273 . . . . 0.0 109.955 -176.63 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 596' ' ' HIS . . . . . 0.403 ' HB2' ' HB2' ' A' ' 599' ' ' CYS . 29.4 m80 -81.07 140.61 35.0 Favored 'General case' 0 N--CA 1.471 0.602 0 O-C-N 121.343 -0.848 . . . . 0.0 109.224 168.716 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 23.6 t -62.62 -45.43 92.88 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 123.353 0.661 . . . . 0.0 112.02 -178.695 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 24.5 p -63.36 -44.34 95.1 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 123.871 0.868 . . . . 0.0 112.777 173.929 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 599' ' ' CYS . . . . . 0.403 ' HB2' ' HB2' ' A' ' 596' ' ' HIS . 97.2 m -57.77 -53.57 56.72 Favored 'General case' 0 CA--C 1.544 0.72 0 CA-C-N 119.134 0.879 . . . . 0.0 111.404 176.897 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 80.9 t80 -57.82 -45.79 85.63 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.335 1.054 . . . . 0.0 112.308 177.367 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 48.1 t-80 -62.9 -43.05 99.84 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 124.005 0.922 . . . . 0.0 113.011 177.628 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 62.9 mt-10 -73.0 -30.38 63.74 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 123.867 0.867 . . . . 0.0 113.117 178.342 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 51.5 m -73.21 -35.68 66.38 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 124.267 1.027 . . . . 0.0 112.13 175.01 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 604' ' ' SER . . . . . . . . . . . . . 33.3 t -63.91 134.04 54.4 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.273 1.029 . . . . 0.0 112.072 174.202 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 605' ' ' GLN . . . . . . . . . . . . . 76.1 mt-30 -143.25 161.02 39.39 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 125.691 1.596 . . . . 0.0 111.488 -175.911 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 606' ' ' ASN . . . . . . . . . . . . . 62.3 t30 55.99 33.37 21.66 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 125.561 1.544 . . . . 0.0 113.954 179.854 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 607' ' ' SER . . . . . . . . . . . . . 24.2 t -67.06 -27.25 67.23 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 124.72 1.208 . . . . 0.0 113.646 -175.796 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 608' ' ' SER . . . . . . . . . . . . . 39.8 m . . . . . 0 C--O 1.254 1.309 0 C-N-CA 127.14 2.176 . . . . 0.0 113.475 179.736 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 533' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.498 0 N-CA-C 111.206 -0.758 . . . . 0.0 111.206 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . -176.13 165.85 36.61 Favored Glycine 0 CA--C 1.537 1.408 0 C-N-CA 124.571 1.081 . . . . 0.0 113.38 178.246 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 535' ' ' SER . . . . . . . . . . . . . 82.6 p -76.42 164.22 26.2 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.976 1.31 . . . . 0.0 112.931 176.384 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 536' ' ' GLU . . . . . . . . . . . . . 60.9 mt-10 -74.25 93.51 2.36 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 124.086 0.955 . . . . 0.0 111.213 173.446 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 537' ' ' PHE . . . . . . . . . . . . . 23.8 t80 -147.3 134.78 20.84 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.454 1.502 . . . . 0.0 109.944 175.943 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 28.9 t -80.83 -81.51 0.13 Allowed 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 115.237 1.569 . . . . 0.0 115.237 -168.054 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 539' ' ' ASP . . . . . . . . . . . . . 12.7 p-10 -80.73 153.53 27.77 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 124.586 1.155 . . . . 0.0 112.953 -170.81 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 540' ' ' ARG . . . . . . . . . . . . . 6.5 mpt_? 51.12 42.31 28.55 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 124.943 1.297 . . . . 0.0 112.337 -176.385 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 47.3 t -146.81 163.93 34.44 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 126.839 2.055 . . . . 0.0 111.207 -174.927 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 542' ' ' ASN . . . . . . . . . . . . . 81.3 m-20 -60.0 -25.61 65.4 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.003 0.921 . . . . 0.0 113.367 178.526 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 29.6 tp10 -58.65 -35.07 71.94 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 124.199 0.999 . . . . 0.0 113.065 173.441 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 10.5 tt -76.11 -43.69 42.11 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 124.024 0.93 . . . . 0.0 110.942 172.659 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -70.36 -46.6 63.79 Favored 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 114.144 1.164 . . . . 0.0 114.144 -171.433 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 24.0 mm -60.67 -32.12 50.93 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.003 0 CA-C-N 118.925 0.784 . . . . 0.0 111.324 -174.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 88.8 mtt-85 -70.1 -30.38 67.59 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 124.105 0.962 . . . . 0.0 112.959 176.905 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -79.73 -9.47 86.77 Favored Glycine 0 CA--C 1.536 1.369 0 C-N-CA 125.637 1.589 . . . . 0.0 114.535 178.572 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 58.9 mtpt -75.64 132.62 40.73 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.719 1.207 . . . . 0.0 111.154 177.063 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 23.5 p90 -153.3 166.55 32.24 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 125.234 1.414 . . . . 0.0 111.387 176.141 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -130.89 133.72 62.69 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 C-N-CA 124.915 1.286 . . . . 0.0 110.483 175.671 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 73.4 t -64.15 134.34 29.04 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 C-N-CA 124.168 0.987 . . . . 0.0 110.405 -178.152 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 59.0 t -70.97 116.5 47.07 Favored Pre-proline 0 CA--C 1.544 0.739 0 CA-C-O 118.627 -0.702 . . . . 0.0 109.467 173.741 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -83.37 154.8 14.21 Favored 'Trans proline' 0 N--CA 1.457 -0.642 0 C-N-CA 123.546 2.831 . . . . 0.0 111.607 179.949 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 3.9 pm0 -64.37 -22.39 66.94 Favored 'General case' 0 N--CA 1.471 0.577 0 O-C-N 121.089 -1.007 . . . . 0.0 112.675 174.435 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 67.6 p -71.85 -17.65 62.12 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 125.131 1.372 . . . . 0.0 113.064 175.936 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 61.0 p -74.05 -35.53 64.29 Favored 'General case' 0 N--CA 1.48 1.066 0 CA-C-N 119.278 0.945 . . . . 0.0 112.177 175.811 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 57.3 tt0 59.76 -49.17 0.08 Allowed 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 129.94 3.296 . . . . 0.0 115.994 -177.366 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 71.8 m-20 -80.23 -11.15 59.76 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.6 1.56 . . . . 0.0 113.883 177.719 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 63.5 mtp 57.59 27.19 13.8 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 125.889 1.675 . . . . 0.0 114.517 -179.3 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -145.83 147.65 32.05 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.327 1.051 . . . . 0.0 113.483 -175.421 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 40.2 m-85 -149.79 164.97 33.87 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 127.051 2.14 . . . . 0.0 110.276 175.304 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 38.1 ttmt -114.09 132.04 56.18 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 124.496 1.119 . . . . 0.0 112.815 -177.881 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 13.1 t -66.94 112.67 10.34 Favored Pre-proline 0 CA--C 1.542 0.655 0 C-N-CA 126.284 1.834 . . . . 0.0 109.744 168.437 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -70.16 -18.87 34.84 Favored 'Trans proline' 0 CA--C 1.54 0.796 0 C-N-CA 122.5 2.134 . . . . 0.0 113.024 176.494 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 36.5 mt -70.93 -50.11 45.32 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 C-N-CA 124.839 1.256 . . . . 0.0 110.968 -175.886 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 15.6 p -108.55 -2.09 19.15 Favored 'General case' 0 CA--C 1.552 1.028 0 C-N-CA 124.906 1.283 . . . . 0.0 113.607 178.425 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 568' ' ' LYS . . . . . . . . . . . . . 96.0 mttt 60.44 46.59 9.63 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 126.913 2.085 . . . . 0.0 112.697 -177.507 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 72.1 mm-40 -126.04 141.88 51.76 Favored 'General case' 0 N--CA 1.481 1.078 0 N-CA-C 114.688 1.366 . . . . 0.0 114.688 -176.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 93.7 m -86.23 130.56 34.48 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 123.781 0.832 . . . . 0.0 112.979 -176.535 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 3.0 m -94.78 151.43 3.82 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.891 0 C-N-CA 125.779 1.631 . . . . 0.0 111.088 167.514 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 65.8 p -134.15 149.52 51.05 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 125.414 1.486 . . . . 0.0 111.27 178.158 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -67.69 143.8 42.67 Favored Glycine 0 CA--C 1.536 1.363 0 C-N-CA 124.219 0.914 . . . . 0.0 114.868 -177.42 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 98.8 t -139.67 136.0 39.51 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 125.596 1.558 . . . . 0.0 112.091 -179.703 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 75.2 t80 -73.25 123.58 23.99 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 120.241 1.382 . . . . 0.0 112.97 -177.262 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 16.1 t0 -91.62 123.01 34.7 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 125.641 1.576 . . . . 0.0 111.274 169.979 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -72.37 -24.59 61.29 Favored 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 114.131 1.16 . . . . 0.0 114.131 177.125 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -73.84 -53.74 9.55 Favored 'General case' 0 N--CA 1.476 0.826 0 CA-C-N 119.09 0.859 . . . . 0.0 111.661 -176.299 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 15.4 t -78.6 -27.46 45.55 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 123.831 0.853 . . . . 0.0 112.201 172.749 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 79.45 32.54 37.83 Favored Glycine 0 CA--C 1.532 1.144 0 C-N-CA 124.032 0.825 . . . . 0.0 113.2 -175.754 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 77.6 mm-40 -141.49 155.92 45.79 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.73 1.612 . . . . 0.0 111.777 -170.421 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 79.7 m95 -76.08 138.32 40.74 Favored 'General case' 0 CA--C 1.534 0.358 0 O-C-N 120.967 -1.083 . . . . 0.0 111.468 173.584 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 18.7 m -138.8 151.03 23.62 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.019 0 C-N-CA 126.657 1.983 . . . . 0.0 113.002 -173.273 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 4.3 m0 -94.93 104.19 16.07 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 126.376 1.87 . . . . 0.0 108.639 168.632 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 53.9 mtmt -69.5 145.87 52.34 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 124.305 1.042 . . . . 0.0 111.443 -177.487 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 48.0 t30 48.96 44.76 22.65 Favored 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 125.326 1.45 . . . . 0.0 112.194 -178.236 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 87.9 m -131.77 146.35 52.1 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 124.528 1.131 . . . . 0.0 111.993 -173.058 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 13.0 tt -139.66 151.79 22.53 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.724 0 C-N-CA 127.967 2.507 . . . . 0.0 109.979 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 81.0 tt0 -107.93 117.77 35.01 Favored 'General case' 0 N--CA 1.472 0.67 0 O-C-N 120.889 -1.132 . . . . 0.0 110.734 172.099 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 5.0 t -144.18 138.38 24.13 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 C-N-CA 125.511 1.524 . . . . 0.0 110.506 -175.567 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 14.5 m120 54.39 34.49 20.9 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 124.973 1.309 . . . . 0.0 113.678 -179.57 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 75.77 11.27 84.68 Favored Glycine 0 CA--C 1.536 1.4 0 C-N-CA 124.773 1.178 . . . . 0.0 115.58 -179.329 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 64.1 mttp -132.21 157.08 45.24 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 125.96 1.704 . . . . 0.0 111.614 -179.298 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 74.8 m-85 -88.38 130.97 35.02 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 121.685 0.755 . . . . 0.0 111.566 174.241 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 12.1 m-30 -124.72 156.68 37.25 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 127.104 2.162 . . . . 0.0 109.696 -176.523 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 596' ' ' HIS . . . . . 0.406 ' HB2' ' HB2' ' A' ' 599' ' ' CYS . 29.6 m80 -79.87 140.98 36.55 Favored 'General case' 0 N--CA 1.47 0.573 0 O-C-N 120.837 -1.164 . . . . 0.0 108.184 167.085 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 19.1 m -66.8 -38.31 86.26 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 118.841 0.746 . . . . 0.0 112.262 -179.251 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 23.4 p -65.65 -37.86 87.72 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 123.872 0.869 . . . . 0.0 113.187 172.042 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 599' ' ' CYS . . . . . 0.406 ' HB2' ' HB2' ' A' ' 596' ' ' HIS . 68.0 m -61.71 -58.63 7.28 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 123.881 0.872 . . . . 0.0 110.089 172.7 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 58.1 t80 -53.48 -39.64 64.69 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 125.329 1.452 . . . . 0.0 113.517 -179.782 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 82.1 t60 -60.79 -27.16 67.81 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 113.85 1.056 . . . . 0.0 113.85 177.619 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 57.7 mm-40 -109.36 -7.95 15.14 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 125.571 1.549 . . . . 0.0 114.258 -179.958 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 19.3 m -66.94 -36.78 83.0 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 124.572 1.149 . . . . 0.0 113.082 -173.857 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 604' ' ' SER . . . . . . . . . . . . . 12.5 t -152.31 166.5 31.62 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 124.092 0.957 . . . . 0.0 112.325 179.678 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 605' ' ' GLN . . . . . . . . . . . . . 29.5 pt20 -60.54 149.4 34.71 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.79 1.236 . . . . 0.0 112.471 174.456 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 606' ' ' ASN . . . . . . . . . . . . . 28.1 m120 -79.78 -88.95 0.06 Allowed 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 123.848 0.859 . . . . 0.0 112.379 -174.529 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 607' ' ' SER . . . . . . . . . . . . . 37.0 m 53.89 -164.2 0.1 Allowed 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 125.328 1.451 . . . . 0.0 113.626 -175.539 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 608' ' ' SER . . . . . . . . . . . . . 80.8 p . . . . . 0 C--O 1.253 1.288 0 C-N-CA 126.562 1.945 . . . . 0.0 113.059 178.111 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 533' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.486 0 N-CA-C 111.117 -0.793 . . . . 0.0 111.117 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . -69.86 166.72 49.26 Favored Glycine 0 CA--C 1.537 1.426 0 C-N-CA 124.091 0.853 . . . . 0.0 113.909 175.768 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 535' ' ' SER . . . . . . . . . . . . . 21.9 m -63.46 137.84 58.29 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.55 1.14 . . . . 0.0 112.871 -178.229 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 536' ' ' GLU . . . . . . . . . . . . . 24.0 tp10 -152.46 128.24 10.2 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 125.819 1.648 . . . . 0.0 109.21 175.689 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 537' ' ' PHE . . . . . . . . . . . . . 70.0 t80 -72.65 127.52 32.8 Favored 'General case' 0 CA--C 1.54 0.594 0 N-CA-C 113.053 0.76 . . . . 0.0 113.053 -171.581 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 22.7 t -160.75 50.26 0.26 Allowed 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 126.504 1.921 . . . . 0.0 108.766 171.907 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 539' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -129.06 179.09 5.95 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 125.484 1.513 . . . . 0.0 113.882 -167.257 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 540' ' ' ARG . . . . . . . . . . . . . 62.5 mtp85 63.96 4.0 1.85 Allowed 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 127.531 2.332 . . . . 0.0 116.642 175.41 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 45.7 m -65.99 160.01 24.57 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.977 1.311 . . . . 0.0 112.02 169.439 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 542' ' ' ASN . . . . . . . . . . . . . 16.2 p-10 -59.58 -23.94 63.35 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 113.673 0.99 . . . . 0.0 113.673 176.795 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 52.7 mt-10 -55.46 -30.94 61.48 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.608 1.163 . . . . 0.0 112.824 175.348 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 10.0 mp -59.66 -36.17 75.88 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 119.321 0.964 . . . . 0.0 111.793 175.773 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 82.2 mm-40 -84.66 -43.8 14.03 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 123.619 0.768 . . . . 0.0 112.818 178.511 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 34.9 mm -69.1 -28.29 38.57 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.835 0 O-C-N 121.914 -0.491 . . . . 0.0 111.824 -178.25 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . 0.269 0.0 OUTLIER -76.27 -13.94 60.14 Favored 'General case' 0 N--CA 1.486 1.347 0 O-C-N 120.505 -1.372 . . . . 0.0 113.54 175.856 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -70.6 -12.95 70.91 Favored Glycine 0 CA--C 1.537 1.414 0 C-N-CA 124.751 1.167 . . . . 0.0 113.9 170.914 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 32.0 mmtp -75.03 127.6 33.61 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 118.767 1.283 . . . . 0.0 110.364 171.245 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 39.9 p90 -149.62 164.24 35.68 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 123.854 0.861 . . . . 0.0 112.713 173.737 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -134.24 133.15 55.63 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 C-N-CA 126.15 1.78 . . . . 0.0 109.644 174.634 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 53.8 t -67.23 135.28 28.83 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.94 0 C-N-CA 123.774 0.83 . . . . 0.0 110.834 -176.72 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 19.0 t -74.28 116.21 50.58 Favored Pre-proline 0 N--CA 1.474 0.729 0 N-CA-C 108.518 -0.919 . . . . 0.0 108.518 171.523 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_endo -77.05 151.13 30.33 Favored 'Trans proline' 0 N--CA 1.458 -0.586 0 C-N-CA 122.752 2.301 . . . . 0.0 111.302 175.456 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -62.65 -22.36 66.38 Favored 'General case' 0 N--CA 1.477 0.876 0 O-C-N 121.376 -0.827 . . . . 0.0 112.942 175.069 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 20.6 m -64.32 -28.32 69.63 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 125.353 1.461 . . . . 0.0 113.487 171.685 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 42.3 t -78.14 125.97 30.13 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 123.934 0.894 . . . . 0.0 112.181 179.639 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 1.7 pm0 -81.31 152.66 27.45 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.363 1.065 . . . . 0.0 111.868 170.197 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 36.3 m-20 60.75 -11.93 0.05 OUTLIER 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 127.642 2.377 . . . . 0.0 117.365 176.848 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 46.9 mtp 57.34 32.76 22.29 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 126.098 1.759 . . . . 0.0 114.194 173.448 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -151.33 155.54 38.92 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.827 1.251 . . . . 0.0 112.797 -171.674 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -152.97 154.44 34.99 Favored 'General case' 0 CA--C 1.542 0.673 0 N-CA-C 113.09 0.774 . . . . 0.0 113.09 173.237 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 14.5 tptm -77.88 142.0 38.74 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 125.107 1.363 . . . . 0.0 113.226 -178.116 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 14.8 t -94.45 107.25 28.47 Favored Pre-proline 0 CA--C 1.539 0.554 0 C-N-CA 125.165 1.386 . . . . 0.0 108.979 167.736 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 63.9 Cg_endo -67.66 -19.58 47.67 Favored 'Trans proline' 0 CA--C 1.542 0.905 0 C-N-CA 122.162 1.908 . . . . 0.0 113.529 175.851 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 89.0 mt -73.48 -56.86 8.12 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 C-N-CA 124.365 1.066 . . . . 0.0 111.178 -176.473 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 14.9 p -100.17 0.3 40.25 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 124.488 1.115 . . . . 0.0 113.794 179.242 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 568' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 59.58 44.32 14.73 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 126.818 2.047 . . . . 0.0 112.122 -179.423 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 74.7 mm-40 -115.59 -175.35 2.7 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 123.774 0.83 . . . . 0.0 112.154 179.857 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 60.6 m -125.6 128.66 48.24 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 124.403 1.081 . . . . 0.0 110.586 172.078 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 2.3 p -91.83 147.15 5.49 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 C-N-CA 124.357 1.063 . . . . 0.0 111.062 170.161 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 64.3 p -133.4 145.91 50.74 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 124.826 1.25 . . . . 0.0 111.753 -175.299 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -72.04 153.6 49.98 Favored Glycine 0 CA--C 1.537 1.413 0 C-N-CA 124.275 0.941 . . . . 0.0 113.63 -179.939 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 8.8 p -142.69 138.06 28.13 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 C-N-CA 124.362 1.065 . . . . 0.0 112.383 177.972 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 68.9 t80 -71.71 118.37 14.46 Favored 'General case' 0 CA--C 1.544 0.732 0 O-C-N 121.497 -0.752 . . . . 0.0 112.295 -178.364 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 21.8 t0 -85.22 120.9 27.23 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.32 1.048 . . . . 0.0 110.493 170.158 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 53.2 mt-10 -74.36 -22.91 59.0 Favored 'General case' 0 CA--C 1.54 0.565 0 N-CA-C 113.765 1.024 . . . . 0.0 113.765 -178.812 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 34.1 mm-40 -76.52 -51.17 12.22 Favored 'General case' 0 N--CA 1.476 0.849 0 CA-C-N 119.467 1.03 . . . . 0.0 112.998 177.203 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 15.7 t -75.07 -27.44 59.94 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 123.47 0.708 . . . . 0.0 112.071 173.736 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 75.49 32.18 55.32 Favored Glycine 0 CA--C 1.535 1.324 0 C-N-CA 124.829 1.204 . . . . 0.0 112.655 -175.002 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -143.94 150.44 38.35 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 125.506 1.522 . . . . 0.0 112.133 -170.863 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 84.7 m95 -73.71 138.97 45.0 Favored 'General case' 0 CA--C 1.537 0.474 0 O-C-N 121.288 -0.883 . . . . 0.0 111.904 175.429 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 5.5 m -134.84 141.58 42.72 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 C-N-CA 126.115 1.766 . . . . 0.0 112.9 -177.419 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 4.7 m0 -87.51 102.94 15.06 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.739 1.616 . . . . 0.0 108.854 169.338 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 73.5 mmtt -72.8 147.54 45.4 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 123.867 0.867 . . . . 0.0 111.628 -178.581 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 51.3 t30 50.45 43.76 27.0 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.959 1.304 . . . . 0.0 112.271 -177.983 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 93.0 m -126.2 147.19 49.71 Favored 'General case' 0 N--CA 1.48 1.057 0 O-C-N 120.774 -1.203 . . . . 0.0 112.899 -172.095 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 5.6 tt -139.65 144.87 27.75 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.672 0 C-N-CA 127.663 2.385 . . . . 0.0 109.668 179.964 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 87.0 tt0 -117.46 121.04 39.96 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 124.977 1.311 . . . . 0.0 110.198 173.47 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 5.2 t -142.88 131.16 19.96 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.509 0 C-N-CA 125.96 1.704 . . . . 0.0 109.746 -175.164 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 71.5 m-20 52.22 44.72 29.45 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 125.223 1.409 . . . . 0.0 112.737 174.953 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 73.33 9.85 77.93 Favored Glycine 0 CA--C 1.536 1.363 0 C-N-CA 125.157 1.36 . . . . 0.0 115.507 178.915 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 35.9 mtmm -128.58 151.86 48.97 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 126.085 1.754 . . . . 0.0 112.007 -176.415 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 69.4 m-85 -96.72 148.59 22.73 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 124.098 0.959 . . . . 0.0 112.88 174.211 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 65.3 m-85 -149.13 160.1 43.65 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.177 1.391 . . . . 0.0 110.578 177.748 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 596' ' ' HIS . . . . . . . . . . . . . 20.8 m170 -75.19 142.23 43.5 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 167.628 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 8.7 t -67.54 -42.23 83.0 Favored 'General case' 0 N--CA 1.469 0.505 0 O-C-N 121.388 -0.82 . . . . 0.0 111.867 -179.273 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 21.6 p -60.32 -38.76 84.74 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.661 0.785 . . . . 0.0 113.096 173.471 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 599' ' ' CYS . . . . . . . . . . . . . 95.1 m -68.35 -57.61 5.65 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.161 0.984 . . . . 0.0 110.727 177.385 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 54.7 t80 -65.56 -33.51 76.09 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 113.064 0.764 . . . . 0.0 113.064 -175.246 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 82.0 t60 -58.18 -36.88 73.71 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 124.742 1.217 . . . . 0.0 113.108 175.315 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 94.8 mt-10 -89.78 -26.26 20.68 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 113.648 0.981 . . . . 0.0 113.648 176.329 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 83.0 m -84.71 -37.02 21.44 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.121 0.968 . . . . 0.0 113.096 -175.037 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 604' ' ' SER . . . . . . . . . . . . . 80.6 p -63.75 149.97 45.57 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-O 121.349 0.595 . . . . 0.0 111.162 170.535 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 605' ' ' GLN . . . . . . . . . . . . . 19.3 pt20 -63.57 147.5 51.29 Favored 'General case' 0 N--CA 1.474 0.738 0 O-C-N 121.525 -0.734 . . . . 0.0 112.329 -176.478 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 606' ' ' ASN . . . . . . . . . . . . . 22.3 t-20 -62.57 131.85 50.45 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 123.748 0.819 . . . . 0.0 112.434 -174.246 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 607' ' ' SER . . . . . . . . . . . . . 80.1 p -109.54 1.59 19.84 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 126.207 1.803 . . . . 0.0 114.274 -177.053 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 608' ' ' SER . . . . . . . . . . . . . 26.1 m . . . . . 0 C--O 1.255 1.367 0 C-N-CA 126.09 1.756 . . . . 0.0 114.007 -177.794 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 533' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.601 0 N-CA-C 110.993 -0.843 . . . . 0.0 110.993 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . -164.27 24.4 0.18 Allowed Glycine 0 CA--C 1.538 1.505 0 C-N-CA 124.277 0.942 . . . . 0.0 114.513 -176.638 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 535' ' ' SER . . . . . . . . . . . . . 86.6 p -159.07 167.32 29.54 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 125.91 1.684 . . . . 0.0 111.467 -173.586 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 536' ' ' GLU . . . . . . . . . . . . 0.26 6.6 pt-20 58.17 -4.2 0.06 Allowed 'General case' 0 N--CA 1.483 1.179 0 N-CA-C 119.119 3.007 . . . . 0.0 119.119 171.32 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 537' ' ' PHE . . . . . . . . . . . . . 9.5 p90 -143.05 -176.28 4.85 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 125.043 1.337 . . . . 0.0 112.606 174.34 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 14.8 m -49.23 150.14 1.83 Allowed 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 127.15 2.18 . . . . 0.0 115.139 -174.717 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 539' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -61.2 -14.53 26.18 Favored 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 116.379 1.992 . . . . 0.0 116.379 -169.008 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 540' ' ' ARG . . . . . . . . . . . . . 3.3 mmp_? -54.37 -39.17 66.92 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 124.702 1.201 . . . . 0.0 112.702 172.865 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 23.5 m 54.42 -63.85 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 128.972 2.909 . . . . 0.0 117.907 171.331 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 542' ' ' ASN . . . . . . . . . . . . . 78.2 m-20 -72.97 -13.38 61.23 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 126.173 1.789 . . . . 0.0 114.934 -169.11 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 14.8 pt-20 -57.35 -27.49 62.3 Favored 'General case' 0 CA--C 1.547 0.849 0 CA-C-N 120.185 1.357 . . . . 0.0 114.019 -174.384 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 76.6 mt -74.34 -15.96 60.93 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 125.199 1.4 . . . . 0.0 113.631 175.679 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -107.95 -32.17 7.68 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 126.466 1.906 . . . . 0.0 112.49 178.584 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 5.9 mm -52.54 -42.32 39.4 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.928 0 C-N-CA 125.44 1.496 . . . . 0.0 111.212 173.79 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 38.4 ptt180 -64.4 -22.68 67.03 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 125.145 1.378 . . . . 0.0 114.148 176.816 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -81.25 -9.36 86.11 Favored Glycine 0 CA--C 1.533 1.164 0 C-N-CA 125.63 1.586 . . . . 0.0 114.47 -177.597 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -70.45 143.62 51.72 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 118.348 1.074 . . . . 0.0 110.684 173.336 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 38.9 p90 -151.46 165.68 33.44 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 124.09 0.956 . . . . 0.0 112.528 177.576 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -131.16 134.14 61.68 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 C-N-CA 125.612 1.565 . . . . 0.0 110.137 174.326 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 10.8 p -70.6 133.67 31.43 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 C-N-CA 123.723 0.809 . . . . 0.0 110.965 -176.164 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 5.1 t -85.24 120.26 73.18 Favored Pre-proline 0 C--O 1.238 0.493 0 C-N-CA 125.101 1.36 . . . . 0.0 110.321 173.824 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -76.5 146.25 27.29 Favored 'Trans proline' 0 C--N 1.352 0.713 0 C-N-CA 122.28 1.987 . . . . 0.0 111.146 169.583 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -62.92 -23.49 67.39 Favored 'General case' 0 N--CA 1.476 0.858 0 O-C-N 121.444 -0.785 . . . . 0.0 112.794 179.283 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 67.7 p -68.73 -18.23 64.2 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 125.49 1.516 . . . . 0.0 113.934 172.851 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 15.3 t -74.99 43.17 0.2 Allowed 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 124.881 1.272 . . . . 0.0 114.271 174.758 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 55.6 tt0 46.84 -99.13 0.04 OUTLIER 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 127.841 2.456 . . . . 0.0 114.226 170.121 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 79.7 m-20 -94.79 4.66 53.56 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 125.719 1.607 . . . . 0.0 114.712 -174.741 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 13.9 mtt 57.98 36.99 26.63 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 124.891 1.277 . . . . 0.0 114.083 -179.811 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -138.76 152.51 47.99 Favored 'General case' 0 CA--C 1.54 0.589 0 O-C-N 120.713 -1.242 . . . . 0.0 114.277 -176.584 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 17.6 t80 -151.06 174.15 13.52 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 126.139 1.776 . . . . 0.0 109.391 172.615 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 7.0 ttpm? -125.0 129.51 50.46 Favored 'General case' 0 N--CA 1.481 1.106 0 CA-C-N 120.702 1.592 . . . . 0.0 112.846 179.222 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 49.0 t -65.07 117.79 42.97 Favored Pre-proline 0 CA--C 1.538 0.482 0 C-N-CA 126.521 1.928 . . . . 0.0 111.032 172.778 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -63.96 -27.33 66.43 Favored 'Trans proline' 0 CA--C 1.54 0.791 0 C-N-CA 123.037 2.492 . . . . 0.0 115.114 176.437 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 97.0 mt -74.44 -55.18 12.83 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 124.174 0.989 . . . . 0.0 111.606 -172.492 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 15.3 p -100.74 -0.18 37.72 Favored 'General case' 0 CA--C 1.553 1.059 0 C-N-CA 124.287 1.035 . . . . 0.0 113.449 179.41 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 568' ' ' LYS . . . . . . . . . . . . . 1.6 mptp? 59.3 44.37 15.5 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 126.351 1.86 . . . . 0.0 112.041 -179.448 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 64.8 mm-40 -118.09 135.84 53.95 Favored 'General case' 0 N--CA 1.481 1.121 0 N-CA-C 114.312 1.227 . . . . 0.0 114.312 -173.954 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 94.0 m -76.13 116.11 16.51 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 123.427 0.691 . . . . 0.0 111.486 179.738 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 4.8 p -83.42 144.01 10.85 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.706 0 C-N-CA 124.49 1.116 . . . . 0.0 109.558 168.342 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 58.6 p -131.53 145.19 51.62 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 124.823 1.249 . . . . 0.0 110.692 178.82 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -68.7 138.01 31.21 Favored Glycine 0 CA--C 1.529 0.922 0 C-N-CA 124.327 0.965 . . . . 0.0 112.152 178.958 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 83.9 t -127.26 140.95 47.65 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.595 0 C-N-CA 124.583 1.153 . . . . 0.0 111.213 -176.586 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 65.9 t80 -64.91 124.2 21.42 Favored 'General case' 0 CA--C 1.545 0.784 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 -174.051 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 65.1 t0 -87.54 99.11 11.79 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 126.57 1.948 . . . . 0.0 109.803 172.269 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 -64.65 -24.45 67.59 Favored 'General case' 0 N--CA 1.473 0.712 0 N-CA-C 114.402 1.26 . . . . 0.0 114.402 -174.745 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 35.5 tp10 -75.34 -53.36 8.87 Favored 'General case' 0 N--CA 1.471 0.598 0 O-C-N 121.383 -0.823 . . . . 0.0 112.395 -179.187 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 65.2 m -87.74 -21.47 25.15 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 124.276 1.03 . . . . 0.0 113.189 179.5 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 79.91 30.35 43.42 Favored Glycine 0 CA--C 1.533 1.166 0 C-N-CA 124.712 1.149 . . . . 0.0 112.992 -175.382 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 79.2 mm-40 -111.33 -167.46 1.18 Allowed 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 125.861 1.664 . . . . 0.0 110.87 -177.5 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 73.3 m95 -125.41 145.89 49.86 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 125.399 1.48 . . . . 0.0 110.022 171.981 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 16.4 m -139.41 143.71 30.45 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.057 0 C-N-CA 124.838 1.255 . . . . 0.0 113.12 -172.135 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 12.3 m0 -94.35 102.05 14.03 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 126.036 1.735 . . . . 0.0 108.999 170.463 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 53.5 mtmt -74.14 151.13 40.13 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 125.828 1.651 . . . . 0.0 112.61 -177.275 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 54.3 t30 49.89 38.28 15.65 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 125.443 1.497 . . . . 0.0 112.825 -176.134 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 97.2 m -118.66 140.53 49.77 Favored 'General case' 0 N--CA 1.48 1.07 0 O-C-N 121.136 -0.978 . . . . 0.0 112.942 -172.212 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 14.0 tt -132.45 145.49 34.45 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.534 0 C-N-CA 127.729 2.412 . . . . 0.0 110.12 177.737 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 78.7 tt0 -108.86 131.99 54.46 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 124.861 1.264 . . . . 0.0 110.776 170.198 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 7.1 p -152.66 140.32 13.61 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 C-N-CA 124.786 1.235 . . . . 0.0 110.707 176.51 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 60.2 t30 53.4 37.68 26.1 Favored 'General case' 0 CA--C 1.553 1.084 0 C-N-CA 124.695 1.198 . . . . 0.0 113.21 179.268 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 73.35 10.2 78.49 Favored Glycine 0 CA--C 1.545 1.919 0 C-N-CA 124.828 1.204 . . . . 0.0 115.605 -179.678 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 55.4 mtmt -130.96 154.11 48.48 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 125.767 1.627 . . . . 0.0 111.979 -176.313 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 68.8 m-85 -92.91 149.56 21.17 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-O 121.949 0.88 . . . . 0.0 113.18 176.211 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -149.08 165.29 32.16 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 126.873 2.069 . . . . 0.0 109.489 -179.622 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 596' ' ' HIS . . . . . . . . . . . . . 26.1 m80 -83.52 141.49 31.59 Favored 'General case' 0 N--CA 1.467 0.388 0 O-C-N 121.68 -0.638 . . . . 0.0 109.58 168.424 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 15.3 m -64.93 -43.06 94.0 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 112.251 0.463 . . . . 0.0 112.251 -177.137 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 40.4 p -67.91 -41.75 82.19 Favored 'General case' 0 N--CA 1.481 1.104 0 N-CA-C 112.953 0.724 . . . . 0.0 112.953 175.769 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 599' ' ' CYS . . . . . . . . . . . . . 89.1 m -56.56 -54.37 46.69 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.489 1.116 . . . . 0.0 110.999 173.347 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 71.5 t80 -57.26 -45.06 84.36 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.166 0.987 . . . . 0.0 111.972 177.144 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 86.5 t60 -62.25 -42.53 99.4 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 114.071 1.137 . . . . 0.0 114.071 -179.194 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 75.1 mm-40 -80.21 -30.87 38.71 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 113.93 1.085 . . . . 0.0 113.93 177.186 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 86.6 m -93.92 -44.36 8.12 Favored 'General case' 0 N--CA 1.484 1.253 0 N-CA-C 113.357 0.873 . . . . 0.0 113.357 -171.842 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 604' ' ' SER . . . . . . . . . . . . . 19.5 m -95.02 38.33 1.13 Allowed 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.461 1.505 . . . . 0.0 113.704 -169.138 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 605' ' ' GLN . . . . . . . . . . . . . 55.4 tp60 -61.9 129.98 43.48 Favored 'General case' 0 CA--C 1.545 0.782 0 O-C-N 121.202 -0.936 . . . . 0.0 111.537 176.146 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 606' ' ' ASN . . . . . . . . . . . . . 8.7 p-10 -69.77 158.8 34.75 Favored 'General case' 0 CA--C 1.544 0.741 0 N-CA-C 114.502 1.297 . . . . 0.0 114.502 -177.654 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 607' ' ' SER . . . . . . . . . . . . . 50.8 m -78.46 161.24 27.24 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 124.535 1.134 . . . . 0.0 110.965 167.099 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 608' ' ' SER . . . . . . . . . . . . . 34.4 m . . . . . 0 C--O 1.254 1.331 0 C-N-CA 126.261 1.824 . . . . 0.0 114.151 175.856 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 533' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.46 0 N-CA-C 111.229 -0.749 . . . . 0.0 111.229 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . -79.63 -167.5 34.69 Favored Glycine 0 CA--C 1.54 1.612 0 C-N-CA 124.687 1.137 . . . . 0.0 114.547 177.329 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 535' ' ' SER . . . . . . . . . . . . . 33.6 t -148.09 142.77 26.62 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 125.876 1.67 . . . . 0.0 110.943 177.784 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 536' ' ' GLU . . . . . . . . . . . . . 56.2 mp0 -74.02 135.05 43.09 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.457 1.103 . . . . 0.0 113.106 -175.856 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 537' ' ' PHE . . . . . . . . . . . . . 52.7 p90 -156.73 175.82 13.55 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 126.301 1.84 . . . . 0.0 110.628 171.365 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 21.7 t -140.42 168.74 19.1 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.859 1.264 . . . . 0.0 112.426 -178.714 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 539' ' ' ASP . . . . . . . . . . . . . 67.3 m-20 -73.64 12.21 0.68 Allowed 'General case' 0 CA--C 1.55 0.965 0 C-N-CA 126.305 1.842 . . . . 0.0 114.867 -174.336 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 540' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 -63.08 -12.97 30.54 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 125.488 1.515 . . . . 0.0 113.745 173.924 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 81.0 p -56.69 -25.55 54.38 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 125.648 1.579 . . . . 0.0 114.546 -177.139 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 542' ' ' ASN . . . . . . . . . . . . . 29.0 m120 -62.99 -23.68 67.56 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-N 119.801 1.182 . . . . 0.0 113.485 175.346 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 85.8 mt-10 -63.48 -39.94 95.79 Favored 'General case' 0 N--CA 1.474 0.766 0 O-C-N 120.701 -1.25 . . . . 0.0 112.443 178.168 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -69.63 -27.99 65.53 Favored 'General case' 0 N--CA 1.471 0.595 0 O-C-N 121.42 -0.8 . . . . 0.0 112.047 176.92 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 57.7 mt-10 -71.4 -40.76 70.31 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 123.583 0.753 . . . . 0.0 112.186 174.57 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 31.4 mm -63.14 -37.29 79.01 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 C-N-CA 123.415 0.686 . . . . 0.0 111.022 172.17 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -69.93 -28.5 65.63 Favored 'General case' 0 N--CA 1.481 1.083 0 O-C-N 121.459 -0.775 . . . . 0.0 112.444 174.58 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -76.45 -9.08 86.08 Favored Glycine 0 CA--C 1.539 1.536 0 C-N-CA 125.435 1.493 . . . . 0.0 115.042 176.623 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 9.7 mmpt? -67.19 141.41 57.33 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-N 119.477 1.639 . . . . 0.0 111.14 172.349 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 51.5 p90 -153.79 164.83 37.68 Favored 'General case' 0 C--O 1.24 0.563 0 C-N-CA 124.354 1.062 . . . . 0.0 112.27 170.854 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 6.5 m -129.74 137.15 57.43 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 C-N-CA 126.19 1.796 . . . . 0.0 108.971 169.493 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 9.2 p -66.49 134.84 29.46 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.923 0 O-C-N 121.167 -0.958 . . . . 0.0 110.043 -179.312 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 3.3 t -88.09 114.55 59.82 Favored Pre-proline 0 CA--C 1.54 0.567 0 C-N-CA 123.68 0.792 . . . . 0.0 109.112 174.564 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 95.5 Cg_endo -74.29 162.97 37.45 Favored 'Trans proline' 0 CA--C 1.534 0.503 0 C-N-CA 122.704 2.269 . . . . 0.0 112.937 -178.826 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 17.1 pt-20 -66.0 -19.56 65.9 Favored 'General case' 0 N--CA 1.477 0.904 0 O-C-N 121.318 -0.864 . . . . 0.0 113.022 172.148 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 76.7 p -80.91 -6.07 58.22 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 126.057 1.743 . . . . 0.0 113.685 172.103 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 44.1 t -60.28 148.02 38.19 Favored 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 114.333 1.234 . . . . 0.0 114.333 -179.168 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 7.2 pt20 -74.32 88.05 2.03 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.953 1.301 . . . . 0.0 111.577 170.955 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 26.6 m-20 56.33 19.28 3.88 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 126.479 1.912 . . . . 0.0 115.175 176.313 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 10.5 mtt 55.75 30.98 16.63 Favored 'General case' 0 N--CA 1.472 0.625 0 N-CA-C 115.259 1.577 . . . . 0.0 115.259 -174.217 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -133.92 139.28 46.04 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.304 1.042 . . . . 0.0 112.637 -178.713 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 5.7 t80 -154.31 159.49 41.25 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 123.361 0.665 . . . . 0.0 112.107 177.74 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -88.88 152.44 21.74 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 125.465 1.506 . . . . 0.0 114.106 -172.74 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 25.3 t -104.16 104.41 43.76 Favored Pre-proline 0 CA--C 1.547 0.863 0 C-N-CA 126.615 1.966 . . . . 0.0 109.347 166.117 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -62.16 -23.49 75.53 Favored 'Trans proline' 0 CA--C 1.54 0.803 0 C-N-CA 123.243 2.629 . . . . 0.0 115.258 178.314 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 79.0 mt -72.96 -54.52 15.59 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 C-N-CA 124.089 0.956 . . . . 0.0 111.044 -176.749 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 14.1 p -102.8 1.19 33.84 Favored 'General case' 0 CA--C 1.551 1.014 0 N-CA-C 113.807 1.04 . . . . 0.0 113.807 -178.409 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 568' ' ' LYS . . . . . . . . . . . . 0.304 0.0 OUTLIER 55.73 43.71 27.45 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 127.808 2.443 . . . . 0.0 113.688 -175.909 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 70.9 mm-40 -110.88 -177.58 3.25 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.096 0.558 . . . . 0.0 112.41 179.568 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 99.1 m -125.9 126.72 44.87 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 124.817 1.247 . . . . 0.0 111.346 177.793 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 1.2 m -87.61 144.7 8.69 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.775 0 C-N-CA 124.645 1.178 . . . . 0.0 110.61 168.681 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 51.4 p -130.63 144.1 51.19 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 124.42 1.088 . . . . 0.0 111.296 176.438 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -67.54 152.81 52.8 Favored Glycine 0 CA--C 1.535 1.294 0 C-N-CA 124.201 0.905 . . . . 0.0 113.845 179.715 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 8.9 p -137.6 142.08 37.53 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 C-N-CA 125.177 1.391 . . . . 0.0 112.14 176.345 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 75.6 t80 -77.21 123.11 25.99 Favored 'General case' 0 CA--C 1.542 0.667 0 O-C-N 120.618 -1.301 . . . . 0.0 112.984 -173.214 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 24.3 t0 -90.08 118.14 29.39 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 124.67 1.188 . . . . 0.0 111.427 169.217 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 63.2 mt-10 -71.84 -27.75 63.1 Favored 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 113.656 0.984 . . . . 0.0 113.656 -178.788 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -75.31 -50.27 16.56 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 123.797 0.839 . . . . 0.0 111.998 -178.398 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 13.0 t -74.18 -28.98 61.54 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.461 0.705 . . . . 0.0 112.268 171.933 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 76.57 29.35 58.0 Favored Glycine 0 CA--C 1.536 1.39 0 C-N-CA 123.651 0.643 . . . . 0.0 112.721 -174.905 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 79.4 mm-40 -141.65 157.48 45.03 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 125.454 1.501 . . . . 0.0 111.106 -173.154 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 75.7 m95 -79.63 146.62 32.41 Favored 'General case' 0 N--CA 1.47 0.554 0 O-C-N 121.157 -0.964 . . . . 0.0 112.007 177.359 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 8.5 m -135.05 138.89 48.22 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 C-N-CA 126.249 1.82 . . . . 0.0 112.433 -177.068 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 0.8 OUTLIER -90.4 100.21 13.09 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 126.062 1.745 . . . . 0.0 107.23 170.229 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 42.7 mtmt -75.48 150.32 38.25 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 123.861 0.864 . . . . 0.0 112.367 179.088 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 54.1 t30 51.45 40.23 26.26 Favored 'General case' 0 CA--C 1.551 1.01 0 C-N-CA 125.627 1.571 . . . . 0.0 112.43 -174.666 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 80.6 m -125.21 145.88 49.77 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 124.149 0.98 . . . . 0.0 112.895 -174.584 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 8.4 tt -142.81 148.16 20.0 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 C-N-CA 127.577 2.351 . . . . 0.0 110.743 -178.825 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 60.4 tt0 -110.38 126.15 53.97 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 125.24 1.416 . . . . 0.0 109.539 169.683 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 2.2 t -142.99 129.57 17.61 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 C-N-CA 126.322 1.849 . . . . 0.0 109.809 -177.041 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 70.1 m-20 52.78 37.09 22.97 Favored 'General case' 0 CA--C 1.551 1.01 0 C-N-CA 125.064 1.346 . . . . 0.0 114.073 174.39 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 79.59 8.21 87.91 Favored Glycine 0 CA--C 1.536 1.397 0 C-N-CA 124.853 1.216 . . . . 0.0 115.485 -179.557 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 56.6 mtmt -127.54 155.46 43.76 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 125.878 1.671 . . . . 0.0 111.408 178.029 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 65.6 m-85 -98.87 149.45 22.9 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 123.905 0.882 . . . . 0.0 112.424 175.996 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 93.5 m-85 -150.58 162.04 41.42 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 126.087 1.755 . . . . 0.0 111.547 -174.924 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 596' ' ' HIS . . . . . 0.402 ' HB2' ' HB2' ' A' ' 599' ' ' CYS . 18.3 m80 -74.69 141.01 44.57 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 166.935 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 9.2 t -65.09 -40.36 94.49 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 118.219 0.463 . . . . 0.0 111.504 177.471 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 21.4 p -60.67 -45.32 94.59 Favored 'General case' 0 N--CA 1.478 0.938 0 N-CA-C 114.062 1.134 . . . . 0.0 114.062 172.001 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 599' ' ' CYS . . . . . 0.402 ' HB2' ' HB2' ' A' ' 596' ' ' HIS . 98.9 m -62.13 -51.52 67.56 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 123.884 0.874 . . . . 0.0 111.837 177.551 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 68.5 t80 -61.27 -41.97 97.85 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 123.599 0.759 . . . . 0.0 112.012 177.659 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 23.8 t-80 -68.01 -35.14 77.79 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 123.886 0.875 . . . . 0.0 113.263 178.238 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 31.8 tp10 -69.8 -34.21 73.41 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 124.514 1.125 . . . . 0.0 112.384 172.161 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 95.8 m -70.28 -37.06 74.76 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 124.122 0.969 . . . . 0.0 111.765 173.513 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 604' ' ' SER . . . . . . . . . . . . . 52.3 m -73.23 170.1 15.69 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 126.123 1.769 . . . . 0.0 113.37 177.725 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 605' ' ' GLN . . . . . . . . . . . . . 77.0 mt-30 -136.4 163.79 29.64 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.583 1.553 . . . . 0.0 111.4 175.701 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 606' ' ' ASN . . . . . . . . . . . . . 42.6 t30 -67.16 169.18 8.98 Favored 'General case' 0 CA--C 1.554 1.108 0 C-N-CA 124.245 1.018 . . . . 0.0 111.866 171.025 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 607' ' ' SER . . . . . . . . . . . . . 30.8 t -53.8 134.11 42.41 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 124.804 1.242 . . . . 0.0 113.125 -177.297 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 608' ' ' SER . . . . . . . . . . . . . 31.4 t . . . . . 0 C--O 1.254 1.34 0 C-N-CA 126.337 1.855 . . . . 0.0 111.632 -172.963 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 533' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.628 0 N-CA-C 110.964 -0.854 . . . . 0.0 110.964 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 534' ' ' GLY . . . . . . . . . . . . . . . -80.8 -12.41 82.79 Favored Glycine 0 CA--C 1.538 1.512 0 N-CA-C 115.641 1.016 . . . . 0.0 115.641 -176.923 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 535' ' ' SER . . . . . . . . . . . . . 91.2 p -92.24 158.69 16.0 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 125.457 1.503 . . . . 0.0 113.764 -178.304 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 536' ' ' GLU . . . . . . . . . . . . . 17.2 pt-20 -93.92 11.76 28.39 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 126.115 1.766 . . . . 0.0 113.467 176.805 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 537' ' ' PHE . . . . . . . . . . . . . 10.0 m-30 -70.31 0.95 5.48 Favored 'General case' 0 CA--C 1.547 0.857 0 N-CA-C 116.595 2.072 . . . . 0.0 116.595 -167.879 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 38.2 t -149.41 -52.87 0.16 Allowed 'General case' 0 N--CA 1.478 0.927 0 CA-C-N 119.645 1.111 . . . . 0.0 113.546 174.778 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 539' ' ' ASP . . . . . . . . . . . . . 39.9 t0 52.34 43.4 30.85 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 124.665 1.186 . . . . 0.0 113.167 -178.324 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 540' ' ' ARG . . . . . . . . . . . . . 61.9 ttt180 -142.33 142.09 32.44 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 125.394 1.478 . . . . 0.0 111.941 -172.964 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 32.1 t -67.25 -28.66 68.23 Favored 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 114.553 1.316 . . . . 0.0 114.553 -169.837 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 542' ' ' ASN . . . . . . . . . . . . . 13.7 p-10 -61.03 -23.07 65.14 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 124.563 1.145 . . . . 0.0 114.087 -174.871 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -59.03 -32.21 69.53 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 124.333 1.053 . . . . 0.0 113.099 173.652 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 75.6 mt -78.48 -36.38 45.27 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 124.374 1.07 . . . . 0.0 112.415 178.613 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -67.25 -33.39 75.23 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 114.062 1.134 . . . . 0.0 114.062 -169.033 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 33.2 mm -62.94 -37.11 78.43 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.881 0 C-N-CA 123.107 0.563 . . . . 0.0 112.142 -176.912 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 547' ' ' ARG . . . . . 0.423 ' H ' ' HD2' ' A' ' 547' ' ' ARG . 0.0 OUTLIER -87.16 -8.99 56.36 Favored 'General case' 0 N--CA 1.48 1.038 0 N-CA-C 113.883 1.068 . . . . 0.0 113.883 177.988 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 548' ' ' GLY . . . . . . . . . . . . . . . -77.69 -12.58 84.34 Favored Glycine 0 CA--C 1.537 1.447 0 C-N-CA 124.677 1.132 . . . . 0.0 114.523 170.301 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -69.75 135.33 49.62 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 118.769 1.284 . . . . 0.0 113.003 -178.462 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 550' ' ' TYR . . . . . . . . . . . . . 42.7 p90 -154.74 162.82 40.97 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 124.737 1.215 . . . . 0.0 112.538 169.979 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 551' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -136.07 133.03 50.43 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.581 0 C-N-CA 126.246 1.819 . . . . 0.0 109.925 179.84 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 9.9 p -67.37 138.94 21.8 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.135 0 C-N-CA 123.633 0.773 . . . . 0.0 111.64 -175.868 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 61.6 t -76.24 115.74 49.77 Favored Pre-proline 0 N--CA 1.473 0.681 0 C-N-CA 124.53 1.132 . . . . 0.0 108.752 169.835 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -79.49 157.72 25.43 Favored 'Trans proline' 0 CA--C 1.54 0.791 0 C-N-CA 122.965 2.443 . . . . 0.0 111.972 176.914 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -64.63 -24.36 67.56 Favored 'General case' 0 CA--C 1.55 0.97 0 N-CA-C 113.414 0.894 . . . . 0.0 113.414 179.897 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 556' ' ' THR . . . . . . . . . . . . . 37.4 p -69.04 -37.36 78.55 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 125.557 1.543 . . . . 0.0 112.453 174.399 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 557' ' ' SER . . . . . . . . . . . . . 60.9 m -79.85 59.88 3.29 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.001 1.321 . . . . 0.0 111.046 171.267 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -65.7 -17.15 64.4 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 124.928 1.291 . . . . 0.0 114.131 -170.276 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 70.2 m-20 -73.85 -17.93 61.0 Favored 'General case' 0 N--CA 1.479 1.011 0 O-C-N 120.902 -1.124 . . . . 0.0 113.142 169.59 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 560' ' ' MET . . . . . . . . . . . . . 37.9 mtp 57.29 25.27 10.94 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 127.479 2.311 . . . . 0.0 115.102 176.886 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 561' ' ' ALA . . . . . . . . . . . . . . . -140.96 152.82 45.28 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 124.319 1.048 . . . . 0.0 113.34 -175.073 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -156.1 160.66 40.14 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 126.45 1.9 . . . . 0.0 110.009 175.736 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 563' ' ' LYS . . . . . . . . . . . . . 77.6 tttt -100.77 151.63 21.45 Favored 'General case' 0 N--CA 1.48 1.069 0 O-C-N 121.07 -1.019 . . . . 0.0 112.942 -179.455 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 564' ' ' CYS . . . . . . . . . . . . . 49.0 t -92.22 110.27 43.33 Favored Pre-proline 0 CA--C 1.545 0.765 0 C-N-CA 127.374 2.27 . . . . 0.0 109.431 169.249 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 565' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -62.37 -15.37 44.63 Favored 'Trans proline' 0 CA--C 1.541 0.833 0 C-N-CA 123.919 3.08 . . . . 0.0 116.052 175.81 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 566' ' ' ILE . . . . . . . . . . . . . 96.8 mt -80.05 -62.18 1.49 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.893 0 CA-C-N 119.311 0.959 . . . . 0.0 110.779 -179.239 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 14.7 p -96.96 -0.22 47.81 Favored 'General case' 0 CA--C 1.544 0.75 0 N-CA-C 113.947 1.092 . . . . 0.0 113.947 -177.521 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 568' ' ' LYS . . . . . . . . . . . . . 11.0 mptt 60.83 46.03 9.19 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 127.626 2.371 . . . . 0.0 111.707 -179.773 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 65.9 mm-40 -124.05 142.1 51.47 Favored 'General case' 0 N--CA 1.484 1.257 0 N-CA-C 114.947 1.462 . . . . 0.0 114.947 -175.085 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 88.4 m -87.71 122.41 31.35 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.794 0.838 . . . . 0.0 112.714 -177.42 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 2.9 m -81.98 151.13 4.27 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 C-N-CA 124.554 1.142 . . . . 0.0 110.007 167.243 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 57.6 p -131.96 147.97 52.49 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 124.728 1.211 . . . . 0.0 110.766 173.64 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -64.62 144.04 47.76 Favored Glycine 0 N--CA 1.468 0.825 0 C-N-CA 124.041 0.829 . . . . 0.0 113.775 -179.564 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 574' ' ' VAL . . . . . . . . . . . . . 67.7 t -135.38 128.46 48.31 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.446 0 C-N-CA 125.575 1.55 . . . . 0.0 111.248 -179.52 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 88.3 t80 -67.59 115.72 7.5 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 121.687 -0.633 . . . . 0.0 112.278 -178.803 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 576' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -82.2 121.13 26.23 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 124.126 0.971 . . . . 0.0 110.234 169.888 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 53.0 mt-10 -70.72 -36.27 73.12 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.715 1.206 . . . . 0.0 113.841 -169.572 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -88.92 -33.93 17.1 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 119.041 0.837 . . . . 0.0 113.159 -178.586 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 19.3 m -72.24 -30.58 65.02 Favored 'General case' 0 N--CA 1.476 0.858 0 CA-C-N 118.421 0.555 . . . . 0.0 111.512 169.793 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 580' ' ' GLY . . . . . . . . . . . . . . . 75.14 28.73 61.65 Favored Glycine 0 CA--C 1.535 1.289 0 C-N-CA 125.539 1.543 . . . . 0.0 113.562 -177.3 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 75.0 mm-40 -144.89 148.15 33.58 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 124.394 1.078 . . . . 0.0 112.246 -169.814 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 582' ' ' TRP . . . . . . . . . . . . . 83.8 m95 -75.35 134.65 40.94 Favored 'General case' 0 C--N 1.327 -0.408 0 O-C-N 121.187 -0.946 . . . . 0.0 110.996 177.91 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 17.6 m -137.11 152.25 27.92 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 C-N-CA 126.359 1.864 . . . . 0.0 112.112 -173.704 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 584' ' ' TRP . . . . . . . . . . . . . 5.8 m0 -93.96 102.64 14.74 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 126.011 1.724 . . . . 0.0 108.171 170.781 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 585' ' ' LYS . . . . . . . . . . . . . 72.9 mmtt -78.12 145.44 35.73 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 124.408 1.083 . . . . 0.0 111.944 -178.431 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 60.08 37.64 20.93 Favored 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 125.097 1.359 . . . . 0.0 111.602 -175.691 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 587' ' ' THR . . . . . . . . . . . . . 26.8 m -128.7 149.02 50.86 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 124.783 1.233 . . . . 0.0 112.285 -171.222 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 17.3 tt -135.48 144.86 32.78 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 C-N-CA 127.507 2.323 . . . . 0.0 110.208 178.151 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 589' ' ' GLU . . . . . . . . . . . . . 71.9 tt0 -106.15 125.63 51.23 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.478 1.111 . . . . 0.0 109.783 169.232 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 590' ' ' VAL . . . . . . . . . . . . . 7.7 p -152.4 134.45 5.9 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.712 0 C-N-CA 124.589 1.155 . . . . 0.0 111.318 -175.826 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 70.9 m-20 53.27 35.29 19.73 Favored 'General case' 0 CA--C 1.553 1.093 0 C-N-CA 124.875 1.27 . . . . 0.0 114.266 -178.648 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 592' ' ' GLY . . . . . . . . . . . . . . . 79.99 6.88 88.95 Favored Glycine 0 CA--C 1.538 1.529 0 C-N-CA 124.947 1.261 . . . . 0.0 115.64 179.727 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 593' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -130.43 158.39 40.03 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 125.388 1.475 . . . . 0.0 112.363 -179.383 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 594' ' ' TYR . . . . . . . . . . . . . 78.3 m-85 -92.62 149.48 21.31 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-O 122.049 0.928 . . . . 0.0 113.02 176.222 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 595' ' ' PHE . . . . . . . . . . . . . 77.2 m-85 -152.12 159.98 43.52 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 126.371 1.868 . . . . 0.0 109.746 -176.43 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 596' ' ' HIS . . . . . 0.426 ' HB2' ' HB2' ' A' ' 599' ' ' CYS . 28.8 m80 -76.76 140.2 40.69 Favored 'General case' 0 N--CA 1.473 0.694 0 O-C-N 120.915 -1.116 . . . . 0.0 108.369 167.82 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 597' ' ' SER . . . . . . . . . . . . . 53.1 p -63.76 -40.17 96.05 Favored 'General case' 0 N--CA 1.469 0.513 0 O-C-N 121.732 -0.605 . . . . 0.0 112.254 -177.74 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 7.2 p -69.39 -42.28 75.34 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 124.743 1.217 . . . . 0.0 113.157 174.844 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 599' ' ' CYS . . . . . 0.426 ' HB2' ' HB2' ' A' ' 596' ' ' HIS . 77.4 m -57.45 -54.95 41.05 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.304 1.042 . . . . 0.0 110.896 174.052 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 61.9 t80 -55.49 -49.01 73.66 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 124.09 0.956 . . . . 0.0 111.889 178.44 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 601' ' ' HIS . . . . . . . . . . . . . 86.3 t60 -63.21 -40.32 97.15 Favored 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 113.114 0.783 . . . . 0.0 113.114 -178.795 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 602' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -71.45 -37.89 71.37 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 123.855 0.862 . . . . 0.0 112.657 176.83 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 91.6 m -86.02 -31.93 21.75 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 124.321 1.048 . . . . 0.0 113.549 -171.651 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 604' ' ' SER . . . . . . . . . . . . . 34.2 t -64.26 122.31 16.35 Favored 'General case' 0 N--CA 1.469 0.501 0 O-C-N 121.47 -0.769 . . . . 0.0 112.016 -177.616 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 605' ' ' GLN . . . . . . . . . . . . . 2.0 tm0? -78.94 144.07 35.18 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.541 1.136 . . . . 0.0 111.736 179.41 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 606' ' ' ASN . . . . . . . . . . . . . 80.6 m-20 -67.8 -28.64 67.77 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 124.126 0.97 . . . . 0.0 113.16 175.464 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 607' ' ' SER . . . . . . . . . . . . . 6.0 t 58.69 -165.32 0.18 Allowed 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 125.872 1.669 . . . . 0.0 113.468 -178.08 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 608' ' ' SER . . . . . . . . . . . . . 80.5 p . . . . . 0 C--O 1.253 1.241 0 C-N-CA 125.821 1.648 . . . . 0.0 114.541 179.554 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_