data_5i22_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 5i22 _Structure_validation_residue.Date_analyzed 2016-10-08 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 14.1 mt . . . . . 0 CA--C 1.543 0.703 0 N-CA-C 112.23 0.456 . . . . 0.0 112.23 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -66.5 160.53 45.38 Favored 'Trans proline' 0 CA--C 1.537 0.631 0 C-N-CA 123.408 2.739 . . . . 0.0 113.401 -174.46 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 44.6 Cg_endo -59.05 133.15 51.43 Favored 'Trans proline' 0 N--CA 1.458 -0.564 0 C-N-CA 123.155 2.57 . . . . 0.0 110.656 -177.918 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 70.57 2.45 43.41 Favored Glycine 0 CA--C 1.537 1.451 0 CA-C-O 117.422 -1.765 . . . . 0.0 116.378 -178.803 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 19.6 t80 -34.6 131.61 0.34 Allowed 'General case' 0 CA--C 1.543 0.711 0 N-CA-C 117.76 2.504 . . . . 0.0 117.76 179.733 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 52.8 mtm -100.38 -57.02 2.21 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 -176.379 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 523' ' ' PHE . . . . . . . . . . . . . 32.7 p90 -167.58 173.7 8.38 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 127.963 2.505 . . . . 0.0 110.848 -176.093 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 524' ' ' LYS . . . . . 0.502 ' HE2' ' CD2' ' A' ' 548' ' ' LEU . 85.3 mttt -106.34 160.31 15.47 Favored 'General case' 0 N--CA 1.47 0.558 0 O-C-N 121.212 -0.93 . . . . 0.0 111.22 172.358 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 15.5 m -130.24 161.28 40.3 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 C-N-CA 126.184 1.794 . . . . 0.0 109.39 165.377 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 26.9 tt0 -127.41 128.83 46.46 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 119.541 1.064 . . . . 0.0 111.803 172.001 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 527' ' ' ALA . . . . . . . . . . . . . . . -60.99 127.98 34.2 Favored 'General case' 0 CA--C 1.538 0.494 0 O-C-N 121.188 -0.945 . . . . 0.0 111.288 179.566 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 29.3 mm-40 -94.43 -25.75 16.78 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.49 1.516 . . . . 0.0 111.237 173.261 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 77.3 m-70 -135.66 162.9 31.43 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 127.444 2.298 . . . . 0.0 109.367 -178.652 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -90.51 143.31 26.87 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 121.117 -0.989 . . . . 0.0 113.29 177.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 89.6 t80 -136.25 125.29 24.37 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.978 1.311 . . . . 0.0 114.054 -177.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 3.5 m -96.92 120.64 37.64 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 113.785 1.032 . . . . 0.0 113.785 174.107 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -65.54 116.94 7.32 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-O 121.541 0.686 . . . . 0.0 111.901 -176.952 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 13.1 t -81.46 -28.54 34.11 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 123.897 0.879 . . . . 0.0 113.27 -173.82 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -140.36 176.72 8.54 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 116.268 1.951 . . . . 0.0 116.268 -165.343 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 536' ' ' THR . . . . . . . . . . . . 0.305 0.6 OUTLIER -75.84 -5.53 46.42 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 118.86 2.911 . . . . 0.0 118.86 -162.333 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . 0.389 1.6 p-10 -110.39 -10.22 14.59 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 115.832 1.79 . . . . 0.0 115.832 165.787 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 30.4 mp0 -80.4 145.2 32.11 Favored 'General case' 0 CA--C 1.557 1.238 0 N-CA-C 114.798 1.407 . . . . 0.0 114.798 -167.777 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -97.76 138.35 35.25 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 129.303 3.041 . . . . 0.0 110.699 -177.561 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 20.4 tt0 -90.49 135.0 33.97 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 123.958 0.903 . . . . 0.0 112.354 175.032 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 80.0 mt -126.75 145.75 50.49 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 125.159 1.384 . . . . 0.0 112.469 -179.691 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 9.9 tmtt? -112.32 141.2 46.33 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 125.34 1.456 . . . . 0.0 108.803 167.362 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -52.11 109.84 0.42 Allowed 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 118.888 0.767 . . . . 0.0 110.748 174.179 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 115.9 -8.81 18.91 Favored Glycine 0 CA--C 1.535 1.295 0 C-N-CA 125.797 1.665 . . . . 0.0 114.807 -174.651 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 64.5 m-20 -72.47 121.11 19.04 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 119.959 1.88 . . . . 0.0 114.279 -179.48 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 6.5 t -71.48 135.52 27.77 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 CA-C-N 118.688 0.676 . . . . 0.0 110.404 164.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -123.53 123.77 68.11 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.489 0 C-N-CA 125.813 1.645 . . . . 0.0 110.828 174.839 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 548' ' ' LEU . . . . . 0.502 ' CD2' ' HE2' ' A' ' 524' ' ' LYS . 21.6 mt -81.11 100.63 9.14 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 108.118 -1.067 . . . . 0.0 108.118 179.148 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 549' ' ' VAL . . . . . . . . . . . . . 5.7 t -60.43 130.02 23.72 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.166 0 N-CA-C 113.811 1.041 . . . . 0.0 113.811 174.31 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 10.2 pt -127.37 157.47 72.6 Favored Pre-proline 0 CA--C 1.549 0.936 0 C-N-CA 126.77 2.028 . . . . 0.0 110.514 177.263 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_endo -74.58 151.28 41.56 Favored 'Trans proline' 0 CA--C 1.54 0.812 0 C-N-CA 123.813 3.009 . . . . 0.0 111.729 172.402 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 42.0 m-85 . . . . . 0 CA--C 1.539 0.523 0 N-CA-C 118.013 2.597 . . . . 0.0 118.013 -177.379 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 33.9 tt0 . . . . . 0 C--O 1.235 0.321 0 CA-C-O 122.731 1.253 . . . . 0.0 111.739 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . 0.254 48.7 m-20 -71.82 139.21 48.84 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 125.587 1.555 . . . . 0.0 114.427 174.395 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -70.18 124.6 24.52 Favored 'General case' 0 CA--C 1.541 0.629 0 O-C-N 120.754 -1.216 . . . . 0.0 110.944 -174.046 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 84.79 1.08 89.11 Favored Glycine 0 CA--C 1.54 1.595 0 N-CA-C 115.089 0.796 . . . . 0.0 115.089 -171.536 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 46.4 m95 -102.34 163.76 12.05 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 125.194 1.398 . . . . 0.0 113.554 179.564 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 14.5 mt -132.89 150.59 52.15 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 125.724 1.609 . . . . 0.0 109.856 170.155 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 54.8 ttm -106.12 140.57 38.88 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 124.208 1.003 . . . . 0.0 112.03 170.017 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -166.17 -172.57 33.66 Favored Glycine 0 CA--C 1.522 0.52 0 C-N-CA 124.37 0.986 . . . . 0.0 112.797 173.748 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 14.5 p -130.35 140.99 47.44 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.551 0 C-N-CA 125.405 1.482 . . . . 0.0 108.9 169.473 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 39.8 mtmt -58.6 136.24 57.56 Favored 'General case' 0 CA--C 1.52 -0.174 0 O-C-N 121.53 -0.731 . . . . 0.0 111.44 176.489 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -60.63 -40.89 93.59 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 117.663 -1.16 . . . . 0.0 111.783 -178.74 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 57.4 m -68.84 -35.59 77.14 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 120.52 1.509 . . . . 0.0 111.878 176.649 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -58.59 -33.11 69.62 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 114.05 1.129 . . . . 0.0 114.05 171.793 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 62.9 t-105 -84.77 -34.48 22.79 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.798 1.639 . . . . 0.0 113.888 174.709 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 7.8 t-20 -71.42 -22.0 61.91 Favored 'General case' 0 CA--C 1.552 1.023 0 C-N-CA 126.671 1.989 . . . . 0.0 111.984 175.006 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 41.4 mt-30 -85.55 -5.76 59.25 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 126.266 1.826 . . . . 0.0 113.04 167.083 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 21.7 m-70 58.49 38.38 25.53 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 127.392 2.277 . . . . 0.0 113.255 172.86 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 71.9 mttt -75.14 166.06 24.25 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 126.33 1.852 . . . . 0.0 112.476 177.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 3.2 pm0 -51.25 96.73 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 126.043 1.737 . . . . 0.0 114.644 177.685 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 42.8 tp -55.7 -49.32 73.32 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 126.057 1.743 . . . . 0.0 112.448 -170.079 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 64.0 mt-10 -67.73 -13.08 61.81 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 114.521 1.304 . . . . 0.0 114.521 -176.142 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 43.7 mmtm -105.18 -25.13 12.6 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 125.569 1.548 . . . . 0.0 112.898 172.466 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 90.3 m -82.61 -28.18 30.98 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 114.117 1.154 . . . . 0.0 114.117 178.109 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 36.4 ptt180 -70.24 161.65 29.91 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 124.454 1.102 . . . . 0.0 112.917 176.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -173.91 174.79 46.41 Favored Glycine 0 N--CA 1.468 0.812 0 C-N-CA 124.651 1.12 . . . . 0.0 114.493 176.526 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 13.1 m -93.27 137.33 22.77 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 C-N-CA 125.065 1.346 . . . . 0.0 112.7 172.033 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 39.8 p90 -132.33 155.68 80.99 Favored Pre-proline 0 CA--C 1.539 0.553 0 C-N-CA 125.098 1.359 . . . . 0.0 114.004 178.004 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 62.6 Cg_endo -66.75 107.82 1.34 Allowed 'Trans proline' 0 N--CA 1.458 -0.616 0 C-N-CA 122.49 2.127 . . . . 0.0 109.87 168.813 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 17.6 pt-20 -51.8 -30.06 21.66 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 124.558 1.143 . . . . 0.0 113.11 178.912 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 11.9 p-10 -70.67 -13.99 62.29 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 126.842 2.057 . . . . 0.0 114.33 179.437 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 9.9 m-85 -76.52 -14.62 60.01 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 116.384 1.994 . . . . 0.0 116.384 165.697 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 589' ' ' THR . . . . . . . . . . . . . 71.0 p -121.07 173.22 7.41 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 125.617 1.567 . . . . 0.0 111.871 -174.333 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -125.18 140.44 52.86 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 124.175 0.99 . . . . 0.0 110.195 171.417 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 15.4 tpt180 -62.97 114.74 3.86 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 124.682 1.193 . . . . 0.0 110.014 171.122 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 592' ' ' VAL . . . . . . . . . . . . . 2.0 m . . . . . 0 N--CA 1.476 0.861 0 C-N-CA 124.521 1.128 . . . . 0.0 108.87 177.328 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 79.7 Cg_endo . . . . . 0 CA--C 1.542 0.91 0 N-CA-C 113.185 0.417 . . . . 0.0 113.185 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 11.8 t -132.12 128.27 58.87 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.12 0 C-N-CA 124.904 1.281 . . . . 0.0 112.71 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -67.21 136.63 93.85 Favored Pre-proline 0 CA--C 1.549 0.94 0 O-C-N 121.389 -0.82 . . . . 0.0 112.633 -176.896 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -77.41 162.28 30.92 Favored 'Trans proline' 0 CA--C 1.548 1.183 0 C-N-CA 123.032 2.488 . . . . 0.0 113.561 -175.559 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 61.8 Cg_endo . . . . . 0 CA--C 1.54 0.794 0 C-N-CA 123.447 2.765 . . . . 0.0 112.909 -178.709 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 12.1 mt . . . . . 0 CA--C 1.537 0.469 0 N-CA-C 111.213 0.079 . . . . 0.0 111.213 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -64.47 159.48 44.09 Favored 'Trans proline' 0 N--CA 1.458 -0.591 0 C-N-CA 122.986 2.457 . . . . 0.0 112.94 -174.178 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -62.5 135.58 54.06 Favored 'Trans proline' 0 N--CA 1.457 -0.662 0 C-N-CA 122.503 2.135 . . . . 0.0 109.89 177.318 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 77.57 -3.69 58.76 Favored Glycine 0 CA--C 1.531 1.06 0 CA-C-O 117.358 -1.801 . . . . 0.0 115.217 -179.762 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 32.8 t80 -34.64 125.05 0.53 Allowed 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 117.202 2.297 . . . . 0.0 117.202 -176.781 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 45.7 mtm -94.45 -51.43 4.77 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 112.241 0.46 . . . . 0.0 112.241 -178.019 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 523' ' ' PHE . . . . . . . . . . . . . 22.6 p90 -171.0 167.12 7.35 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 127.645 2.378 . . . . 0.0 112.609 -172.072 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 524' ' ' LYS . . . . . 0.438 ' HE2' ' CD2' ' A' ' 548' ' ' LEU . 72.1 mttt -96.81 160.27 14.46 Favored 'General case' 0 CA--C 1.534 0.332 0 O-C-N 121.234 -0.916 . . . . 0.0 111.027 166.699 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 32.1 m -134.56 158.49 41.77 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 C-N-CA 126.297 1.839 . . . . 0.0 108.614 166.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 40.1 tt0 -125.43 130.16 51.29 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-N 119.327 0.967 . . . . 0.0 112.343 173.989 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 527' ' ' ALA . . . . . . . . . . . . . . . -64.98 117.9 8.3 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 124.488 1.115 . . . . 0.0 111.426 -177.669 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 75.7 mm-40 -80.87 -29.13 35.8 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 123.474 0.709 . . . . 0.0 111.459 173.497 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 97.8 m-70 -136.83 160.11 39.84 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 125.894 1.678 . . . . 0.0 111.295 -177.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . 0.312 4.6 p30 -82.33 136.36 35.03 Favored 'General case' 0 CA--C 1.546 0.807 0 N-CA-C 115.651 1.723 . . . . 0.0 115.651 178.817 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 82.3 t80 -140.26 128.75 22.78 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 126.095 1.758 . . . . 0.0 112.955 -178.551 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 2.6 m -104.17 135.77 45.03 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 124.864 1.266 . . . . 0.0 113.985 175.501 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -73.23 126.77 30.85 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 112.85 0.685 . . . . 0.0 112.85 -173.452 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 2.8 p -90.96 -3.66 57.12 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 127.757 2.423 . . . . 0.0 116.051 177.669 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 24.6 t0 -148.97 159.47 44.17 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.383 1.473 . . . . 0.0 107.878 -170.225 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 2.0 t -67.24 -20.86 65.73 Favored 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 115.048 1.499 . . . . 0.0 115.048 169.448 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 13.8 t0 -82.53 -20.36 36.8 Favored 'General case' 0 CA--C 1.551 0.986 0 C-N-CA 123.349 0.66 . . . . 0.0 110.426 177.562 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 72.1 mt-10 -82.13 153.12 26.2 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 125.252 1.421 . . . . 0.0 114.744 -173.867 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -98.54 139.1 34.78 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 127.684 2.393 . . . . 0.0 110.307 176.668 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 14.3 tt0 -91.38 130.88 37.17 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.001 0.92 . . . . 0.0 111.07 172.233 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 73.4 mt -128.61 139.96 52.01 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 124.939 1.296 . . . . 0.0 112.245 -177.535 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 14.3 tmtt? -110.55 145.7 37.33 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 126.257 1.823 . . . . 0.0 109.872 171.177 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -59.21 94.24 0.02 OUTLIER 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 124.231 1.013 . . . . 0.0 112.5 177.675 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 131.45 -8.81 5.6 Favored Glycine 0 CA--C 1.532 1.099 0 C-N-CA 126.522 2.01 . . . . 0.0 114.758 -173.399 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 86.2 m-20 -70.7 122.22 19.41 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 119.766 1.783 . . . . 0.0 114.248 -178.547 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 3.4 t -72.2 135.96 26.71 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.415 0 CA-C-N 118.378 0.535 . . . . 0.0 110.546 163.281 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 1.3 t -125.1 123.78 66.1 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.453 0 C-N-CA 126.749 2.02 . . . . 0.0 110.607 177.052 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 548' ' ' LEU . . . . . 0.438 ' CD2' ' HE2' ' A' ' 524' ' ' LYS . 26.7 mt -81.38 98.69 8.32 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 108.15 -1.056 . . . . 0.0 108.15 177.752 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 549' ' ' VAL . . . . . . . . . . . . . 5.9 t -62.93 132.05 28.62 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.132 0 N-CA-C 114.315 1.228 . . . . 0.0 114.315 175.277 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 15.0 pt -126.63 154.72 75.53 Favored Pre-proline 0 CA--C 1.546 0.807 0 C-N-CA 126.502 1.921 . . . . 0.0 110.395 176.865 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 89.4 Cg_endo -75.69 142.37 25.76 Favored 'Trans proline' 0 C--O 1.241 0.645 0 C-N-CA 123.901 3.067 . . . . 0.0 111.807 177.465 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 48.4 m-85 . . . . . 0 CA--C 1.537 0.478 0 N-CA-C 115.552 1.686 . . . . 0.0 115.552 178.757 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 48.2 tt0 . . . . . 0 C--O 1.236 0.346 0 CA-C-O 121.837 0.827 . . . . 0.0 112.388 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 56.2 m-20 -82.67 141.81 32.18 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 125.262 1.425 . . . . 0.0 109.324 175.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 87.4 tt0 -76.94 125.94 30.15 Favored 'General case' 0 N--CA 1.471 0.59 0 O-C-N 120.633 -1.292 . . . . 0.0 110.543 -176.181 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 84.64 7.81 83.84 Favored Glycine 0 CA--C 1.537 1.466 0 CA-C-O 118.869 -0.962 . . . . 0.0 114.978 -171.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 43.3 m95 -111.7 155.97 22.62 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 125.709 1.603 . . . . 0.0 114.016 -179.6 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 12.6 mt -123.96 159.3 30.07 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.384 1.073 . . . . 0.0 110.725 172.098 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 51.9 ttm -118.32 143.25 46.75 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 125.051 1.341 . . . . 0.0 111.383 173.004 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -173.56 -167.54 33.43 Favored Glycine 0 CA--C 1.525 0.707 0 C-N-CA 124.256 0.931 . . . . 0.0 112.741 178.277 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 14.7 p -136.03 142.02 40.06 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 C-N-CA 125.378 1.471 . . . . 0.0 109.342 172.738 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 36.4 mtmt -58.1 135.09 56.96 Favored 'General case' 0 N--CA 1.468 0.475 0 O-C-N 121.338 -0.851 . . . . 0.0 110.876 174.989 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -59.41 -39.49 83.61 Favored 'General case' 0 C--O 1.221 -0.43 0 CA-C-O 117.711 -1.138 . . . . 0.0 111.349 177.35 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 7.6 t -68.14 -35.39 78.0 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 120.294 1.406 . . . . 0.0 111.239 179.396 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 83.8 m-20 -65.1 -33.48 76.13 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 115.184 1.55 . . . . 0.0 115.184 171.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 58.4 t-105 -83.72 -32.14 25.67 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 125.08 1.352 . . . . 0.0 113.235 175.505 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 18.4 t-20 -75.2 -14.02 60.5 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 127.133 2.173 . . . . 0.0 111.982 172.47 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 8.6 mm-40 -82.45 -4.78 58.02 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 126.676 1.99 . . . . 0.0 113.846 162.705 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 574' ' ' HIS . . . . . . . . . . . . 0.251 69.4 m-70 57.47 27.92 14.7 Favored 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 126.268 1.827 . . . . 0.0 114.735 -179.376 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 22.4 mtpp -72.35 161.82 30.31 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 126.322 1.849 . . . . 0.0 112.893 179.293 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -59.88 105.05 0.34 Allowed 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.184 1.394 . . . . 0.0 113.546 179.109 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 58.6 tp -56.95 -42.58 80.37 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 126.017 1.727 . . . . 0.0 112.283 -174.528 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 15.2 pm0 -55.96 -33.07 64.44 Favored 'General case' 0 CA--C 1.542 0.662 0 N-CA-C 114.545 1.313 . . . . 0.0 114.545 178.257 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 2.0 tppp? -88.98 -43.48 11.1 Favored 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 125.447 1.499 . . . . 0.0 110.786 177.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 87.2 m -74.83 -24.54 58.62 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 126.457 1.903 . . . . 0.0 115.146 -173.474 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 46.9 ptt85 -63.56 165.62 7.81 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 125.035 1.334 . . . . 0.0 113.585 177.598 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -172.6 174.9 45.76 Favored Glycine 0 CA--C 1.525 0.701 0 CA-C-N 115.031 -0.986 . . . . 0.0 114.639 165.534 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 32.7 m -91.97 144.51 9.11 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 C-N-CA 124.264 1.026 . . . . 0.0 111.085 166.221 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 38.3 p90 -138.24 154.38 73.85 Favored Pre-proline 0 CA--C 1.539 0.543 0 C-N-CA 125.02 1.328 . . . . 0.0 113.055 177.183 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 65.2 Cg_endo -66.71 108.79 1.51 Allowed 'Trans proline' 0 N--CA 1.457 -0.649 0 C-N-CA 121.786 1.657 . . . . 0.0 109.141 170.259 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -58.83 -21.57 56.92 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 124.01 0.924 . . . . 0.0 113.27 -178.717 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 10.5 p-10 -73.45 -8.19 54.85 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 125.752 1.621 . . . . 0.0 114.16 174.147 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 13.0 m-85 -82.7 -16.5 47.9 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 116.047 1.869 . . . . 0.0 116.047 168.036 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 589' ' ' THR . . . . . . . . . . . . . 17.7 p -122.13 -179.99 4.35 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.449 1.5 . . . . 0.0 108.452 -172.112 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -140.92 142.55 34.41 Favored 'General case' 0 CA--C 1.536 0.429 0 O-C-N 120.721 -1.237 . . . . 0.0 110.23 171.021 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -52.37 135.73 32.58 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 125.407 1.483 . . . . 0.0 110.811 172.968 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 592' ' ' VAL . . . . . . . . . . . . . 1.7 m . . . . . 0 N--CA 1.475 0.816 0 C-N-CA 125.574 1.55 . . . . 0.0 109.412 175.055 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo . . . . . 0 CA--C 1.54 0.792 0 CA-C-O 121.967 0.736 . . . . 0.0 113.865 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 6.8 p -135.05 126.36 46.45 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.706 0 C-N-CA 126.364 1.865 . . . . 0.0 110.387 -177.692 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -65.49 135.9 95.99 Favored Pre-proline 0 CA--C 1.546 0.801 0 O-C-N 121.172 -0.955 . . . . 0.0 111.778 -175.515 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 4.5 Cg_endo -69.07 162.81 40.19 Favored 'Trans proline' 0 CA--C 1.539 0.752 0 C-N-CA 122.292 1.995 . . . . 0.0 112.179 177.896 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo . . . . . 0 CA--C 1.538 0.696 0 C-N-CA 122.537 2.158 . . . . 0.0 111.842 168.345 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 11.0 mt . . . . . 0 CA--C 1.542 0.652 0 CA-C-O 120.555 0.217 . . . . 0.0 111.517 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_endo -68.06 159.36 53.39 Favored 'Trans proline' 0 CA--C 1.54 0.796 0 C-N-CA 123.458 2.772 . . . . 0.0 113.709 -173.768 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -62.92 126.78 18.78 Favored 'Trans proline' 0 C--N 1.347 0.492 0 C-N-CA 123.763 2.976 . . . . 0.0 111.182 -178.44 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 78.72 1.19 83.02 Favored Glycine 0 CA--C 1.533 1.172 0 CA-C-O 117.385 -1.786 . . . . 0.0 115.653 -177.265 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 27.1 t80 -34.84 137.22 0.13 Allowed 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 117.192 2.293 . . . . 0.0 117.192 179.222 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 39.6 mtm -106.29 -61.85 1.46 Allowed 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 123.891 0.876 . . . . 0.0 111.928 -178.073 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 523' ' ' PHE . . . . . . . . . . . . . 23.9 p90 -161.06 170.17 21.02 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 127.28 2.232 . . . . 0.0 112.082 -172.724 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 524' ' ' LYS . . . . . 0.441 ' HE2' ' CD2' ' A' ' 548' ' ' LEU . 71.9 mttt -104.9 163.83 12.24 Favored 'General case' 0 N--CA 1.467 0.399 0 O-C-N 121.148 -0.97 . . . . 0.0 111.288 170.358 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 8.3 m -132.4 156.53 42.5 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.881 0 C-N-CA 126.299 1.84 . . . . 0.0 109.651 165.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 44.2 tt0 -118.38 129.87 55.67 Favored 'General case' 0 N--CA 1.477 0.877 0 CA-C-N 119.795 1.18 . . . . 0.0 111.913 169.394 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 527' ' ' ALA . . . . . . . . . . . . . . . -62.11 121.8 13.96 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.155 0.982 . . . . 0.0 111.786 177.766 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 71.7 mm-40 -89.49 -18.15 27.26 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 125.957 1.703 . . . . 0.0 111.978 172.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 98.7 m-70 -144.93 161.5 39.2 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 127.577 2.351 . . . . 0.0 109.759 -175.443 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -89.5 133.06 34.74 Favored 'General case' 0 C--O 1.237 0.429 0 N-CA-C 107.079 -1.452 . . . . 0.0 107.079 -179.524 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 88.2 t80 -122.61 106.19 10.76 Favored 'General case' 0 C--O 1.235 0.306 0 C-N-CA 124.772 1.229 . . . . 0.0 113.232 177.59 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -80.6 113.84 19.07 Favored 'General case' 0 N--CA 1.469 0.503 0 N-CA-C 113.251 0.834 . . . . 0.0 113.251 170.071 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -71.47 141.63 50.21 Favored 'General case' 0 C--O 1.238 0.485 0 C-N-CA 125.244 1.418 . . . . 0.0 111.881 179.747 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 5.7 t -110.65 -37.01 5.57 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 126.178 1.791 . . . . 0.0 113.455 177.92 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 84.8 m-20 -95.11 152.48 18.31 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 116.968 2.21 . . . . 0.0 116.968 -177.547 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 4.2 t -57.12 -26.89 61.24 Favored 'General case' 0 N--CA 1.481 1.084 0 N-CA-C 116.138 1.903 . . . . 0.0 116.138 179.812 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 8.2 p30 -92.61 -9.37 41.27 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 116.788 2.144 . . . . 0.0 116.788 174.742 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 86.3 mt-10 -75.69 152.11 37.58 Favored 'General case' 0 CA--C 1.537 0.457 0 O-C-N 120.96 -1.088 . . . . 0.0 113.913 -177.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -97.97 132.48 43.5 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 127.561 2.344 . . . . 0.0 109.521 171.577 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 30.0 tt0 -90.03 134.45 34.23 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.037 0.935 . . . . 0.0 111.519 174.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 83.1 mt -127.63 155.36 44.0 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 125.007 1.323 . . . . 0.0 112.819 -178.196 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -129.12 142.31 50.92 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 125.556 1.542 . . . . 0.0 109.728 174.029 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -54.8 105.89 0.18 Allowed 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.34 1.056 . . . . 0.0 112.04 -175.616 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 125.43 -15.01 7.24 Favored Glycine 0 CA--C 1.531 1.061 0 C-N-CA 126.684 2.087 . . . . 0.0 113.814 -176.627 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 84.9 m-20 -73.83 119.64 18.33 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 114.909 1.448 . . . . 0.0 114.909 -171.164 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 21.8 t -70.14 137.78 23.34 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 O-C-N 122.057 -0.402 . . . . 0.0 110.83 169.178 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 1.1 t -125.84 127.55 71.36 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 C-N-CA 126.538 1.935 . . . . 0.0 111.399 174.957 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 548' ' ' LEU . . . . . 0.441 ' CD2' ' HE2' ' A' ' 524' ' ' LYS . 20.4 mt -83.76 101.7 11.78 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.356 1.063 . . . . 0.0 108.742 177.495 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 549' ' ' VAL . . . . . . . . . . . . . 6.3 t -63.88 131.12 29.43 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 N-CA-C 113.986 1.106 . . . . 0.0 113.986 174.436 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 24.6 pt -127.11 157.25 72.79 Favored Pre-proline 0 CA--C 1.548 0.87 0 C-N-CA 126.426 1.89 . . . . 0.0 110.276 177.606 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -70.93 156.43 60.3 Favored 'Trans proline' 0 CA--C 1.534 0.519 0 C-N-CA 123.779 2.986 . . . . 0.0 111.54 174.498 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 54.9 m-85 . . . . . 0 CA--C 1.537 0.471 0 N-CA-C 115.72 1.748 . . . . 0.0 115.72 175.998 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 4.1 tp60 . . . . . 0 N--CA 1.476 0.843 0 N-CA-C 113.178 0.807 . . . . 0.0 113.178 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 13.0 m-20 -120.3 156.29 31.56 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 128.173 2.589 . . . . 0.0 116.125 178.66 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -71.31 110.86 6.21 Favored 'General case' 0 N--CA 1.473 0.716 0 O-C-N 120.345 -1.472 . . . . 0.0 114.093 -165.783 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 82.69 7.63 87.13 Favored Glycine 0 CA--C 1.539 1.545 0 O-C-N 121.117 -0.989 . . . . 0.0 114.605 -175.415 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 47.6 m95 -89.64 165.96 13.91 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 126.013 1.725 . . . . 0.0 113.456 176.407 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 18.9 mt -138.48 158.05 45.0 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 126.003 1.721 . . . . 0.0 110.317 170.4 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 47.8 ttm -115.32 142.78 46.23 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 125.058 1.343 . . . . 0.0 112.078 174.011 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -171.8 -174.8 39.61 Favored Glycine 0 CA--C 1.527 0.812 0 C-N-CA 123.771 0.701 . . . . 0.0 113.328 178.056 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 12.1 p -128.11 141.23 47.02 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.829 0 C-N-CA 125.742 1.617 . . . . 0.0 109.15 171.384 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 31.8 mtmt -57.72 136.56 56.89 Favored 'General case' 0 N--CA 1.467 0.411 0 O-C-N 121.328 -0.858 . . . . 0.0 111.563 175.519 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 15.9 tt0 -58.06 -43.58 86.99 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 118.555 -0.736 . . . . 0.0 110.909 176.809 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 38.5 t -65.68 -36.25 83.1 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-N 118.932 0.787 . . . . 0.0 112.583 178.172 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 79.4 m-20 -65.3 -42.53 92.97 Favored 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 114.828 1.418 . . . . 0.0 114.828 173.515 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 72.9 t-105 -69.04 -35.55 76.72 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.564 1.146 . . . . 0.0 112.92 173.914 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 50.9 t-20 -69.06 -31.35 70.05 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 127.429 2.292 . . . . 0.0 111.737 173.891 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 12.5 mm-40 -82.45 0.74 40.84 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.966 1.306 . . . . 0.0 114.149 172.373 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 83.6 m-70 57.26 38.31 28.63 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 126.753 2.021 . . . . 0.0 113.706 178.268 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 22.3 mtpp -86.31 159.05 19.53 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 125.595 1.558 . . . . 0.0 111.043 179.881 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 12.6 pm0 -56.49 98.71 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 115.029 1.492 . . . . 0.0 115.029 -167.179 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 44.6 tp -50.64 -47.18 58.53 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 125.042 1.337 . . . . 0.0 112.665 -173.229 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 72.4 mm-40 -66.27 -12.64 57.62 Favored 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 114.371 1.248 . . . . 0.0 114.371 -174.124 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 13.1 tptp -117.83 -33.16 4.59 Favored 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 125.501 1.521 . . . . 0.0 113.173 177.684 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 71.1 m -65.22 -31.83 73.19 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 125.635 1.574 . . . . 0.0 112.504 173.119 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 29.6 ptt85 -60.1 157.07 13.73 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 123.737 0.815 . . . . 0.0 112.668 172.215 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -171.96 173.91 45.21 Favored Glycine 0 CA--C 1.524 0.62 0 C-N-CA 123.991 0.805 . . . . 0.0 113.205 173.707 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 35.1 m -91.37 141.43 14.47 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.428 0 C-N-CA 124.008 0.923 . . . . 0.0 110.982 169.356 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 50.5 p90 -137.74 154.6 74.89 Favored Pre-proline 0 CA--C 1.538 0.498 0 C-N-CA 123.959 0.903 . . . . 0.0 113.125 175.838 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_endo -70.37 110.07 2.59 Favored 'Trans proline' 0 N--CA 1.458 -0.613 0 C-N-CA 122.207 1.938 . . . . 0.0 110.034 172.11 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 20.8 pt-20 -55.83 -26.53 47.08 Favored 'General case' 0 N--CA 1.474 0.756 0 O-C-N 121.308 -0.87 . . . . 0.0 112.675 -178.805 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 6.6 p-10 -65.35 -15.36 62.48 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 126.131 1.772 . . . . 0.0 114.48 178.199 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 27.5 m-85 -77.48 -10.99 59.79 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 116.582 2.068 . . . . 0.0 116.582 165.537 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 589' ' ' THR . . . . . . . . . . . . . 80.6 p -131.27 169.78 15.5 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 126.131 1.772 . . . . 0.0 111.734 -171.806 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -125.23 142.45 51.49 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 123.987 0.915 . . . . 0.0 110.228 172.23 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.55 134.5 56.18 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 125.252 1.421 . . . . 0.0 110.999 172.009 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 592' ' ' VAL . . . . . . . . . . . . . 5.4 m . . . . . 0 CA--C 1.553 1.06 0 C-N-CA 124.785 1.234 . . . . 0.0 111.584 -178.546 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 49.8 Cg_endo . . . . . 0 CA--C 1.547 1.125 0 N-CA-C 115.25 1.212 . . . . 0.0 115.25 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 60.3 t -132.65 129.87 58.93 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.068 0 C-N-CA 125.9 1.68 . . . . 0.0 110.73 178.572 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -65.08 131.41 95.15 Favored Pre-proline 0 CA--C 1.556 1.185 0 O-C-N 121.481 -0.762 . . . . 0.0 112.924 -177.348 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 50.4 Cg_endo -74.06 157.3 46.83 Favored 'Trans proline' 0 CA--C 1.541 0.842 0 C-N-CA 123.105 2.537 . . . . 0.0 114.111 -170.15 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo . . . . . 0 CA--C 1.535 0.56 0 C-N-CA 123.808 3.005 . . . . 0.0 112.802 -172.291 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 10.6 mt . . . . . 0 CA--C 1.552 1.042 0 N-CA-C 114.61 1.337 . . . . 0.0 114.61 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -71.0 161.14 47.12 Favored 'Trans proline' 0 CA--C 1.541 0.867 0 C-N-CA 124.655 3.57 . . . . 0.0 113.981 -172.205 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -68.19 123.95 11.19 Favored 'Trans proline' 0 C--O 1.239 0.542 0 C-N-CA 123.481 2.787 . . . . 0.0 111.818 -173.488 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 82.15 1.53 90.37 Favored Glycine 0 CA--C 1.537 1.415 0 CA-C-O 117.757 -1.579 . . . . 0.0 115.808 -175.454 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 30.6 t80 -34.18 132.02 0.28 Allowed 'General case' 0 CA--C 1.546 0.808 0 N-CA-C 118.435 2.754 . . . . 0.0 118.435 -178.53 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 31.7 mtm -101.59 -53.93 2.87 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 113.479 0.918 . . . . 0.0 113.479 -176.732 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 523' ' ' PHE . . . . . . . . . . . . . 19.3 p90 -170.02 171.09 7.21 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 126.508 1.923 . . . . 0.0 111.893 -173.299 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 524' ' ' LYS . . . . . 0.504 ' HE2' ' CD2' ' A' ' 548' ' ' LEU . 76.5 mttt -104.61 163.21 12.64 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-O 122.228 1.013 . . . . 0.0 111.684 167.904 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 12.3 m -134.34 162.44 39.01 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 126.552 1.941 . . . . 0.0 109.55 165.317 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 52.5 tt0 -127.28 129.8 48.38 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 119.035 0.834 . . . . 0.0 112.137 171.136 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 527' ' ' ALA . . . . . . . . . . . . . . . -62.84 129.62 41.27 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.119 0.967 . . . . 0.0 111.302 -178.644 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 62.6 mm-40 -98.08 -12.8 21.46 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 124.915 1.286 . . . . 0.0 112.708 173.461 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 89.0 m-70 -146.74 160.14 42.6 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 128.064 2.545 . . . . 0.0 109.243 -179.87 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 21.4 p-10 -78.53 146.14 34.47 Favored 'General case' 0 N--CA 1.466 0.375 0 O-C-N 121.432 -0.792 . . . . 0.0 111.853 170.061 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 79.3 t80 -139.72 118.27 12.24 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 124.999 1.32 . . . . 0.0 110.846 175.71 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 2.2 m -91.57 132.14 36.51 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 124.909 1.284 . . . . 0.0 113.883 173.546 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -71.19 120.83 17.33 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 123.584 0.754 . . . . 0.0 112.321 -171.208 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 2.4 p -89.23 -5.53 57.58 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 126.216 1.807 . . . . 0.0 115.763 177.595 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 8.6 t0 -147.21 158.79 44.08 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.266 1.026 . . . . 0.0 108.905 178.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 6.3 t -59.79 -23.08 62.99 Favored 'General case' 0 N--CA 1.477 0.914 0 N-CA-C 115.061 1.504 . . . . 0.0 115.061 169.567 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 23.3 t0 -75.62 -33.75 60.54 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 124.512 1.125 . . . . 0.0 110.686 174.771 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 83.6 mt-10 -73.57 147.22 44.11 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.011 1.325 . . . . 0.0 113.345 -171.071 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -92.52 138.16 31.75 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 127.275 2.23 . . . . 0.0 109.825 175.123 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 14.0 tt0 -94.07 119.54 33.07 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 123.956 0.902 . . . . 0.0 111.316 175.492 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 59.5 mt -111.59 142.17 44.23 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 124.447 1.099 . . . . 0.0 111.76 179.272 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 16.0 tptp -106.18 142.19 36.29 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 124.737 1.215 . . . . 0.0 109.816 162.498 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -47.49 121.55 4.03 Favored 'General case' 0 CA--C 1.544 0.726 0 CA-C-O 121.657 0.742 . . . . 0.0 110.881 173.66 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 98.05 -3.81 60.51 Favored Glycine 0 CA--C 1.53 0.998 0 C-N-CA 125.191 1.377 . . . . 0.0 114.127 -178.715 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 82.0 m-20 -67.5 122.11 17.27 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 118.798 1.299 . . . . 0.0 114.228 174.854 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 2.3 t -74.89 135.19 27.84 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 CA-C-N 118.554 0.615 . . . . 0.0 111.552 165.889 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -125.31 121.5 60.69 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 C-N-CA 125.443 1.497 . . . . 0.0 111.744 177.494 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 548' ' ' LEU . . . . . 0.504 ' CD2' ' HE2' ' A' ' 524' ' ' LYS . 17.8 mt -77.13 99.28 5.33 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.609 1.164 . . . . 0.0 108.595 175.241 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 549' ' ' VAL . . . . . . . . . . . . . 2.8 t -60.58 128.48 21.79 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.955 0 N-CA-C 114.011 1.115 . . . . 0.0 114.011 171.142 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 8.7 pt -123.82 154.06 67.22 Favored Pre-proline 0 CA--C 1.547 0.852 0 C-N-CA 126.438 1.895 . . . . 0.0 109.749 177.485 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -70.6 148.9 60.66 Favored 'Trans proline' 0 N--CA 1.461 -0.429 0 C-N-CA 123.653 2.902 . . . . 0.0 110.129 173.862 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 46.7 m-85 . . . . . 0 CA--C 1.535 0.388 0 N-CA-C 114.386 1.254 . . . . 0.0 114.386 176.075 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 50.6 tt0 . . . . . 0 C--O 1.234 0.25 0 CA-C-O 121.962 0.887 . . . . 0.0 112.722 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 68.9 m-20 -94.24 151.82 19.16 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 125.328 1.451 . . . . 0.0 114.109 177.775 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 80.7 tt0 -82.28 119.16 23.75 Favored 'General case' 0 CA--C 1.541 0.597 0 O-C-N 121.053 -1.029 . . . . 0.0 111.907 -167.866 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 81.94 1.58 90.31 Favored Glycine 0 CA--C 1.543 1.797 0 C-N-CA 124.327 0.965 . . . . 0.0 114.834 -171.352 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 47.5 m95 -94.38 167.01 11.79 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 126.78 2.032 . . . . 0.0 113.253 176.45 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 22.7 mt -139.56 159.7 41.55 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 125.192 1.397 . . . . 0.0 110.887 169.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 46.0 ttm -115.17 143.84 44.6 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 125.501 1.52 . . . . 0.0 112.712 176.238 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -167.34 -173.44 35.53 Favored Glycine 0 CA--C 1.525 0.705 0 C-N-CA 124.057 0.837 . . . . 0.0 113.374 175.063 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 14.3 p -129.84 142.03 44.9 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 C-N-CA 125.836 1.655 . . . . 0.0 109.477 170.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 34.0 mtmt -59.04 132.61 54.56 Favored 'General case' 0 N--CA 1.467 0.421 0 O-C-N 121.428 -0.795 . . . . 0.0 111.929 176.189 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 18.3 tt0 -59.42 -42.61 92.23 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 118.473 -0.775 . . . . 0.0 111.124 178.758 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 34.0 t -65.31 -30.79 71.68 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 119.254 0.934 . . . . 0.0 111.963 178.699 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -70.6 -40.77 73.02 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 115.086 1.513 . . . . 0.0 115.086 173.1 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 64.3 t-105 -71.06 -30.42 66.56 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.217 1.407 . . . . 0.0 112.992 172.116 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 10.1 t-20 -67.52 -34.03 76.28 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 126.472 1.909 . . . . 0.0 111.585 172.161 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 35.4 mt-30 -80.77 -0.07 36.98 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 124.886 1.275 . . . . 0.0 113.44 168.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 9.0 m-70 53.78 37.43 26.31 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 126.061 1.744 . . . . 0.0 112.943 179.444 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 6.0 mtpm? -73.17 156.46 38.59 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 125.05 1.34 . . . . 0.0 110.854 175.882 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 12.1 pm0 -57.35 105.79 0.27 Allowed 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 125.038 1.335 . . . . 0.0 114.159 -167.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 55.2 tp -55.25 -48.15 74.39 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 124.505 1.122 . . . . 0.0 112.814 -170.139 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 1.2 pp20? -66.29 -16.45 64.05 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 125.253 1.421 . . . . 0.0 114.651 -175.401 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 32.3 mmtm -106.74 -37.51 6.38 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.681 1.193 . . . . 0.0 112.671 173.213 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 91.2 m -68.47 -28.57 67.15 Favored 'General case' 0 CA--C 1.537 0.479 0 N-CA-C 112.93 0.715 . . . . 0.0 112.93 -179.816 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 38.4 ptt85 -64.29 156.99 27.24 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 113.223 0.823 . . . . 0.0 113.223 176.757 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -169.85 171.04 43.18 Favored Glycine 0 N--CA 1.466 0.697 0 CA-C-N 115.765 -0.652 . . . . 0.0 114.52 176.354 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 17.4 m -90.44 137.16 22.17 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 C-N-CA 124.753 1.221 . . . . 0.0 112.236 172.403 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 48.0 p90 -135.15 155.29 79.07 Favored Pre-proline 0 C--O 1.241 0.629 0 C-N-CA 124.502 1.121 . . . . 0.0 112.932 176.832 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_endo -69.83 109.2 2.27 Favored 'Trans proline' 0 N--CA 1.455 -0.785 0 C-N-CA 121.773 1.649 . . . . 0.0 109.359 169.84 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 20.3 pt-20 -54.41 -23.5 16.08 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 124.16 0.984 . . . . 0.0 113.578 -179.805 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 9.7 p-10 -77.84 -11.29 59.87 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 127.151 2.181 . . . . 0.0 114.755 177.858 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 11.6 m-85 -75.67 -15.76 60.28 Favored 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 116.733 2.123 . . . . 0.0 116.733 162.294 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 589' ' ' THR . . . . . . . . . . . . . 40.8 p -120.16 174.34 6.56 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 125.495 1.518 . . . . 0.0 109.479 -174.596 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -122.34 139.33 53.95 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 123.871 0.869 . . . . 0.0 109.313 172.192 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.03 116.09 8.28 Favored 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 108.088 -1.079 . . . . 0.0 108.088 176.667 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 592' ' ' VAL . . . . . . . . . . . . . 4.6 m . . . . . 0 N--CA 1.474 0.757 0 C-N-CA 124.623 1.169 . . . . 0.0 108.062 175.743 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo . . . . . 0 CA--C 1.536 0.615 0 CA-C-O 121.134 0.389 . . . . 0.0 112.397 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 5.9 t -125.57 129.64 72.75 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.858 0 C-N-CA 124.777 1.231 . . . . 0.0 112.41 -176.624 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -69.34 141.52 91.24 Favored Pre-proline 0 CA--C 1.548 0.896 0 O-C-N 121.818 -0.551 . . . . 0.0 112.163 -177.112 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 3.6 Cg_endo -66.1 162.32 36.12 Favored 'Trans proline' 0 CA--C 1.541 0.864 0 C-N-CA 122.541 2.161 . . . . 0.0 112.596 172.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo . . . . . 0 CA--C 1.54 0.788 0 C-N-CA 123.195 2.597 . . . . 0.0 112.809 163.435 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 13.8 mt . . . . . 0 CA--C 1.546 0.797 0 N-CA-C 111.88 0.326 . . . . 0.0 111.88 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_endo -66.97 159.55 51.39 Favored 'Trans proline' 0 CA--C 1.544 0.99 0 C-N-CA 124.242 3.295 . . . . 0.0 113.932 -172.725 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_endo -61.13 121.72 10.08 Favored 'Trans proline' 0 CA--C 1.536 0.594 0 C-N-CA 123.707 2.938 . . . . 0.0 112.121 -173.298 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 77.54 4.22 84.31 Favored Glycine 0 CA--C 1.536 1.348 0 CA-C-O 117.081 -1.955 . . . . 0.0 116.27 -178.674 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 15.4 t80 -28.17 130.94 0.05 Allowed 'General case' 0 CA--C 1.547 0.851 0 N-CA-C 118.434 2.753 . . . . 0.0 118.434 178.008 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 48.5 mtm -99.41 -53.85 3.11 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 113.283 0.845 . . . . 0.0 113.283 -177.178 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 523' ' ' PHE . . . . . . . . . . . . . 17.8 p90 -166.52 165.96 16.54 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 126.439 1.896 . . . . 0.0 112.942 -172.683 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 524' ' ' LYS . . . . . 0.531 ' HE2' ' CD2' ' A' ' 548' ' ' LEU . 74.0 mttt -98.39 162.48 13.14 Favored 'General case' 0 CA--C 1.539 0.522 0 O-C-N 121.194 -0.942 . . . . 0.0 111.545 165.813 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 19.8 m -135.6 159.54 40.01 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 C-N-CA 126.546 1.938 . . . . 0.0 109.259 167.12 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 30.5 tt0 -122.04 126.86 49.43 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 124.052 0.941 . . . . 0.0 111.441 174.633 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 527' ' ' ALA . . . . . . . . . . . . . . . -61.51 124.28 20.2 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 123.975 0.91 . . . . 0.0 111.629 179.253 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 38.8 mm-40 -87.38 -18.98 28.8 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 125.825 1.65 . . . . 0.0 112.232 176.751 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 97.0 m-70 -148.37 169.12 20.87 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 128.468 2.707 . . . . 0.0 109.84 -177.507 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -83.16 144.55 29.75 Favored 'General case' 0 CA--C 1.539 0.528 0 O-C-N 121.117 -0.989 . . . . 0.0 108.937 172.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 84.3 t80 -134.63 117.25 15.9 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 124.679 1.192 . . . . 0.0 113.234 173.489 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -86.95 116.08 24.77 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 114.335 1.235 . . . . 0.0 114.335 174.486 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -66.25 137.79 57.21 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 123.376 0.67 . . . . 0.0 112.013 177.615 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 13.4 t -112.43 -26.91 8.48 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 125.573 1.549 . . . . 0.0 114.012 175.807 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 27.4 t0 -93.64 149.98 20.79 Favored 'General case' 0 N--CA 1.473 0.721 0 O-C-N 120.857 -1.152 . . . . 0.0 108.323 175.069 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 536' ' ' THR . . . . . . . . . . . . 0.255 0.6 OUTLIER -59.2 -19.56 46.42 Favored 'General case' 0 N--CA 1.469 0.488 0 N-CA-C 115.998 1.851 . . . . 0.0 115.998 165.188 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 38.8 m-20 -82.19 -15.62 52.57 Favored 'General case' 0 CA--C 1.542 0.663 0 N-CA-C 117.625 2.454 . . . . 0.0 117.625 168.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 61.0 mt-10 -86.06 145.43 27.07 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 114.541 1.311 . . . . 0.0 114.541 -172.713 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -87.93 136.1 33.11 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 126.476 1.91 . . . . 0.0 110.415 174.369 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 38.9 tt0 -94.53 129.81 41.18 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 125.176 1.39 . . . . 0.0 110.83 177.478 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 81.4 mt -124.85 154.02 41.68 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 125.112 1.365 . . . . 0.0 112.146 -178.316 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 6.3 tmtm? -126.48 144.27 50.91 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 125.873 1.669 . . . . 0.0 108.223 168.739 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -47.84 117.74 2.0 Favored 'General case' 0 CA--C 1.543 0.709 0 CA-C-O 122.422 1.105 . . . . 0.0 112.267 177.598 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 103.96 -5.14 46.11 Favored Glycine 0 CA--C 1.529 0.968 0 C-N-CA 127.179 2.323 . . . . 0.0 113.577 178.287 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 75.4 m-20 -73.71 127.68 33.45 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 118.945 1.372 . . . . 0.0 114.436 -173.603 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 2.0 t -76.98 135.18 27.15 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 N-CA-C 112.473 0.546 . . . . 0.0 112.473 173.897 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 1.2 t -126.48 122.88 62.08 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 C-N-CA 125.199 1.4 . . . . 0.0 111.81 177.272 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 548' ' ' LEU . . . . . 0.531 ' CD2' ' HE2' ' A' ' 524' ' ' LYS . 17.5 mt -78.03 99.61 6.17 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 124.488 1.115 . . . . 0.0 108.636 174.56 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 549' ' ' VAL . . . . . . . . . . . . . 4.6 t -62.5 128.61 24.57 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.032 0 N-CA-C 113.666 0.987 . . . . 0.0 113.666 171.497 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 10.9 pt -119.45 153.68 53.94 Favored Pre-proline 0 N--CA 1.47 0.552 0 C-N-CA 126.138 1.775 . . . . 0.0 109.817 179.877 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 77.4 Cg_endo -67.11 142.73 62.48 Favored 'Trans proline' 0 N--CA 1.458 -0.596 0 C-N-CA 122.823 2.349 . . . . 0.0 110.443 175.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 552' ' ' PHE . . . . . 0.416 ' CE1' ' HA ' ' A' ' 558' ' ' GLN . 39.1 m-85 . . . . . 0 CA--C 1.53 0.179 0 N-CA-C 117.288 2.329 . . . . 0.0 117.288 -177.087 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 558' ' ' GLN . . . . . 0.416 ' HA ' ' CE1' ' A' ' 552' ' ' PHE . 7.0 tt0 . . . . . 0 N--CA 1.465 0.317 0 CA-C-O 122.035 0.921 . . . . 0.0 112.683 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . 0.296 9.1 m-20 -96.67 138.92 33.51 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 116.744 2.128 . . . . 0.0 116.744 172.775 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 17.3 tp10 -68.05 124.62 23.92 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.695 1.198 . . . . 0.0 111.007 -177.73 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 83.51 -2.99 86.42 Favored Glycine 0 CA--C 1.535 1.341 0 C-N-CA 125.134 1.349 . . . . 0.0 115.173 -171.409 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 50.2 m95 -98.93 161.3 13.7 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 125.312 1.445 . . . . 0.0 112.348 172.891 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 13.1 mt -137.31 154.94 49.98 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 124.688 1.195 . . . . 0.0 110.213 172.263 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 56.5 ttm -116.23 141.14 48.53 Favored 'General case' 0 N--CA 1.464 0.229 0 C-N-CA 124.717 1.207 . . . . 0.0 111.537 178.172 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -173.1 -171.87 38.16 Favored Glycine 0 CA--C 1.522 0.5 0 C-N-CA 123.341 0.496 . . . . 0.0 113.028 -179.836 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 13.2 p -133.17 140.97 45.9 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.634 0 C-N-CA 125.76 1.624 . . . . 0.0 108.916 171.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 35.4 mtmt -58.48 137.85 57.08 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 121.284 -0.885 . . . . 0.0 111.16 176.35 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -60.36 -41.76 94.39 Favored 'General case' 0 C--O 1.22 -0.45 0 CA-C-O 118.9 -0.571 . . . . 0.0 110.707 174.661 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 32.1 t -67.91 -20.18 65.07 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 119.151 0.887 . . . . 0.0 113.062 177.24 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 33.8 m-20 -78.57 -44.92 22.99 Favored 'General case' 0 CA--C 1.541 0.63 0 O-C-N 120.642 -1.287 . . . . 0.0 114.351 168.554 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 66.0 t-105 -72.63 -33.84 66.91 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 125.907 1.683 . . . . 0.0 113.618 177.898 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 44.3 t-20 -71.79 -21.64 61.69 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 127.063 2.145 . . . . 0.0 111.848 172.628 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 75.4 mt-30 -91.2 1.19 57.28 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.972 1.309 . . . . 0.0 113.544 164.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 93.4 m-70 59.68 28.75 18.24 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 126.782 2.033 . . . . 0.0 114.854 170.484 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 75.0 mttt -68.34 163.28 23.42 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 126.144 1.778 . . . . 0.0 111.855 179.245 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 4.8 pm0 -54.72 111.44 0.81 Allowed 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 113.653 0.983 . . . . 0.0 113.653 -175.143 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 50.5 tp -64.0 -34.71 78.63 Favored 'General case' 0 N--CA 1.469 0.504 0 O-C-N 120.659 -1.276 . . . . 0.0 111.223 -169.444 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 32.5 mp0 -72.86 -17.55 61.52 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 125.545 1.538 . . . . 0.0 113.737 -174.415 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 50.1 mmtt -118.91 -25.09 6.37 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 125.334 1.454 . . . . 0.0 114.256 179.223 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 98.0 m -71.32 -33.0 69.27 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 118.526 0.603 . . . . 0.0 112.128 169.211 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 15.1 ptp180 -63.25 165.14 7.77 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-O 121.888 0.851 . . . . 0.0 112.886 173.761 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -178.12 178.63 48.56 Favored Glycine 0 CA--C 1.523 0.531 0 CA-C-N 115.034 -0.985 . . . . 0.0 112.593 171.799 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 27.5 m -93.66 141.48 14.73 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.461 0 C-N-CA 123.758 0.823 . . . . 0.0 110.697 167.293 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 43.8 p90 -134.04 154.48 80.24 Favored Pre-proline 0 C--O 1.24 0.563 0 C-N-CA 124.997 1.319 . . . . 0.0 112.371 175.415 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -68.44 112.48 2.83 Favored 'Trans proline' 0 N--CA 1.459 -0.53 0 C-N-CA 121.86 1.707 . . . . 0.0 109.214 172.398 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 19.5 pt-20 -56.87 -26.98 59.82 Favored 'General case' 0 N--CA 1.476 0.844 0 O-C-N 121.252 -0.905 . . . . 0.0 112.428 -176.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 6.7 p-10 -64.81 -23.73 67.33 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 125.782 1.633 . . . . 0.0 113.594 177.023 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 23.0 m-85 -69.86 -11.63 61.01 Favored 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 117.074 2.25 . . . . 0.0 117.074 166.577 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 589' ' ' THR . . . . . . . . . . . . . 71.5 p -128.53 174.59 9.24 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 125.603 1.561 . . . . 0.0 110.546 -176.391 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -134.37 145.81 49.32 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 123.612 0.765 . . . . 0.0 110.711 169.596 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -58.83 135.14 57.42 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 124.959 1.303 . . . . 0.0 110.804 175.542 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 592' ' ' VAL . . . . . . . . . . . . . 3.1 m . . . . . 0 CA--C 1.544 0.745 0 C-N-CA 126.013 1.725 . . . . 0.0 107.762 173.851 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo . . . . . 0 CA--C 1.54 0.798 0 CA-C-O 122.219 0.841 . . . . 0.0 113.511 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 7.1 t -134.26 129.54 53.49 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 C-N-CA 125.796 1.638 . . . . 0.0 112.123 -176.53 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -69.55 133.79 88.78 Favored Pre-proline 0 CA--C 1.555 1.161 0 O-C-N 121.558 -0.714 . . . . 0.0 112.596 -177.04 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -80.05 164.06 22.55 Favored 'Trans proline' 0 CA--C 1.547 1.161 0 C-N-CA 123.274 2.649 . . . . 0.0 113.353 -177.888 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 77.1 Cg_exo . . . . . 0 CA--C 1.54 0.79 0 C-N-CA 123.716 2.944 . . . . 0.0 114.907 -178.764 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 10.3 mt . . . . . 0 CA--C 1.55 0.972 0 N-CA-C 111.966 0.358 . . . . 0.0 111.966 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -73.15 160.51 45.24 Favored 'Trans proline' 0 CA--C 1.539 0.757 0 C-N-CA 123.677 2.918 . . . . 0.0 113.394 -174.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -62.81 135.0 49.66 Favored 'Trans proline' 0 N--CA 1.459 -0.547 0 C-N-CA 123.353 2.702 . . . . 0.0 110.228 178.867 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 76.82 -1.34 62.93 Favored Glycine 0 CA--C 1.534 1.254 0 CA-C-O 117.295 -1.836 . . . . 0.0 115.508 -178.139 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 49.0 t80 -41.29 131.69 2.73 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 120.683 2.241 . . . . 0.0 115.741 -177.317 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 65.6 mtm -105.52 -56.27 2.2 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 123.269 0.628 . . . . 0.0 111.595 179.547 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 523' ' ' PHE . . . . . . . . . . . . . 21.9 p90 -161.33 168.24 24.31 Favored 'General case' 0 C--O 1.224 -0.239 0 C-N-CA 125.88 1.672 . . . . 0.0 113.35 -173.417 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 524' ' ' LYS . . . . . 0.533 ' HE2' ' CD2' ' A' ' 548' ' ' LEU . 41.9 mttt -98.44 163.58 12.63 Favored 'General case' 0 N--CA 1.469 0.506 0 O-C-N 121.223 -0.923 . . . . 0.0 112.155 165.371 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 13.7 m -133.91 158.48 42.41 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 C-N-CA 126.706 2.002 . . . . 0.0 109.171 164.228 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 54.8 tt0 -122.0 131.57 54.07 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 119.12 0.873 . . . . 0.0 112.034 170.701 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 527' ' ' ALA . . . . . . . . . . . . . . . -64.15 125.38 24.34 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 121.115 -0.991 . . . . 0.0 112.68 179.166 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 58.8 mm-40 -89.54 -23.94 21.88 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 125.791 1.636 . . . . 0.0 112.024 174.04 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 96.6 m-70 -141.28 162.53 35.27 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 126.768 2.027 . . . . 0.0 110.699 -175.323 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -80.67 128.1 33.24 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 125.68 1.592 . . . . 0.0 113.825 176.782 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 86.2 t80 -129.27 115.67 17.97 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.521 1.129 . . . . 0.0 113.933 179.18 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -79.36 121.84 25.63 Favored 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 116.139 1.904 . . . . 0.0 116.139 175.365 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -71.33 124.49 24.67 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 118.723 0.692 . . . . 0.0 111.455 175.533 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 9.8 t -129.41 37.93 3.94 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 127.095 2.158 . . . . 0.0 110.089 -177.399 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 18.6 t0 -161.78 158.2 25.35 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.804 1.642 . . . . 0.0 107.67 166.211 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 3.1 t -62.73 -21.32 65.71 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 114.982 1.475 . . . . 0.0 114.982 164.539 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 29.0 t0 -74.95 -30.07 61.12 Favored 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 125.343 1.457 . . . . 0.0 110.364 173.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 67.7 mt-10 -84.64 154.74 22.35 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 115.515 1.672 . . . . 0.0 115.515 -164.872 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -102.88 134.04 46.96 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 127.449 2.3 . . . . 0.0 110.217 174.118 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 29.5 tt0 -87.63 128.72 35.27 Favored 'General case' 0 CA--C 1.537 0.457 0 O-C-N 121.483 -0.761 . . . . 0.0 110.965 174.661 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 78.2 mt -120.82 146.76 46.2 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 123.971 0.908 . . . . 0.0 111.088 178.53 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 7.3 tmtm? -121.86 144.94 48.54 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 125.447 1.499 . . . . 0.0 108.693 170.47 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -55.24 109.81 0.59 Allowed 'General case' 0 CA--C 1.548 0.871 0 CA-C-O 121.601 0.715 . . . . 0.0 111.622 -177.74 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 118.1 -11.13 13.24 Favored Glycine 0 CA--C 1.534 1.242 0 C-N-CA 126.857 2.17 . . . . 0.0 114.652 -175.539 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 85.9 m-20 -70.38 120.17 15.64 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 119.604 1.702 . . . . 0.0 114.017 -173.795 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 1.8 t -72.39 135.6 27.45 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.088 0 CA-C-N 119.051 0.841 . . . . 0.0 112.547 167.22 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 1.1 t -126.93 122.49 60.49 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.455 0 C-N-CA 126.236 1.814 . . . . 0.0 111.708 177.635 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 548' ' ' LEU . . . . . 0.533 ' CD2' ' HE2' ' A' ' 524' ' ' LYS . 19.1 mt -77.92 101.45 6.84 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 124.845 1.258 . . . . 0.0 108.787 174.548 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 549' ' ' VAL . . . . . . . . . . . . . 5.0 t -63.6 131.42 29.16 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.076 0 N-CA-C 114.252 1.204 . . . . 0.0 114.252 173.497 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 3.8 pt -130.51 154.53 81.65 Favored Pre-proline 0 CA--C 1.547 0.854 0 C-N-CA 127.027 2.131 . . . . 0.0 109.318 177.3 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo -71.9 143.85 41.92 Favored 'Trans proline' 0 CA--C 1.536 0.62 0 C-N-CA 123.442 2.762 . . . . 0.0 110.989 174.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 19.3 m-85 . . . . . 0 N--CA 1.466 0.344 0 N-CA-C 117.739 2.496 . . . . 0.0 117.739 -170.604 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 38.3 tt0 . . . . . 0 CA--C 1.536 0.427 0 N-CA-C 112.685 0.624 . . . . 0.0 112.685 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -101.06 144.92 29.4 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 124.673 1.189 . . . . 0.0 108.496 -173.583 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 43.0 tp10 -73.64 124.36 25.8 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.407 1.083 . . . . 0.0 111.787 -174.694 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 82.01 2.07 90.47 Favored Glycine 0 CA--C 1.54 1.646 0 C-N-CA 124.374 0.987 . . . . 0.0 115.273 -175.844 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 45.2 m95 -97.9 165.98 11.67 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 126.132 1.773 . . . . 0.0 113.427 176.3 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 14.7 mt -133.46 161.28 34.98 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 124.702 1.201 . . . . 0.0 110.654 168.239 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 50.6 ttm -119.29 144.51 46.76 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 125.362 1.465 . . . . 0.0 111.52 176.21 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -173.68 -173.43 39.88 Favored Glycine 0 CA--C 1.527 0.801 0 C-N-CA 124.275 0.941 . . . . 0.0 113.399 177.384 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 13.9 p -130.92 141.73 45.42 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 C-N-CA 126.265 1.826 . . . . 0.0 108.907 172.76 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 26.7 mtmt -61.35 139.44 58.18 Favored 'General case' 0 N--CA 1.468 0.459 0 O-C-N 120.867 -1.146 . . . . 0.0 111.771 177.9 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 20.8 tt0 -61.77 -42.31 98.82 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-O 118.288 -0.863 . . . . 0.0 111.17 178.639 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 24.6 t -65.43 -30.55 71.36 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-N 119.36 0.982 . . . . 0.0 112.61 177.041 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 89.0 m-20 -67.28 -43.58 81.41 Favored 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 114.555 1.317 . . . . 0.0 114.555 171.691 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 64.3 t-105 -71.91 -26.69 62.41 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.885 1.274 . . . . 0.0 113.285 172.694 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 7.3 t-20 -74.47 -31.15 62.13 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.862 1.665 . . . . 0.0 111.093 171.792 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 64.5 mm-40 -77.41 -7.08 55.57 Favored 'General case' 0 N--CA 1.477 0.894 0 CA-C-N 119.09 0.859 . . . . 0.0 113.23 166.799 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 12.1 m-70 63.24 32.09 15.1 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 127.284 2.234 . . . . 0.0 112.728 178.335 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 28.6 mttm -63.27 157.29 23.15 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 125.073 1.349 . . . . 0.0 112.649 179.53 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 3.9 pm0 -52.81 101.19 0.04 OUTLIER 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 124.865 1.266 . . . . 0.0 113.055 -179.448 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 26.4 tp -59.08 -47.95 83.39 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 124.165 0.986 . . . . 0.0 111.351 -163.428 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 21.0 mp0 -73.17 -18.55 61.25 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 115.461 -0.791 . . . . 0.0 112.098 -168.377 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 57.3 tptt -95.56 -36.02 11.43 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 124.69 1.196 . . . . 0.0 112.92 170.022 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 6.3 t -77.9 -22.27 49.95 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 124.112 0.965 . . . . 0.0 112.901 -174.164 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 32.0 ptt180 -64.26 163.11 13.42 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.802 1.241 . . . . 0.0 112.327 171.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -170.56 173.65 44.43 Favored Glycine 0 CA--C 1.526 0.769 0 C-N-CA 123.874 0.749 . . . . 0.0 113.95 175.654 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 19.5 m -91.55 144.16 9.78 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 C-N-CA 124.641 1.176 . . . . 0.0 112.064 170.704 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 47.5 p90 -140.9 153.74 67.8 Favored Pre-proline 0 CA--C 1.543 0.684 0 C-N-CA 124.782 1.233 . . . . 0.0 113.202 177.094 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -65.79 112.16 2.13 Favored 'Trans proline' 0 C--N 1.347 0.484 0 C-N-CA 122.195 1.93 . . . . 0.0 109.543 169.906 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 21.9 pt-20 -54.37 -31.14 54.0 Favored 'General case' 0 N--CA 1.473 0.721 0 O-C-N 121.735 -0.603 . . . . 0.0 112.243 -178.388 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 9.7 p-10 -68.46 -17.36 64.17 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 126.642 1.977 . . . . 0.0 114.318 -179.86 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 19.4 m-85 -72.13 -11.08 60.58 Favored 'General case' 0 CA--C 1.534 0.365 0 N-CA-C 116.269 1.951 . . . . 0.0 116.269 164.369 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 589' ' ' THR . . . . . . . . . . . . . 71.5 p -129.85 166.42 20.0 Favored 'General case' 0 C--O 1.234 0.237 0 C-N-CA 125.809 1.644 . . . . 0.0 112.037 -173.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -122.93 134.34 54.36 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 123.547 0.739 . . . . 0.0 110.377 176.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.84 123.93 21.92 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 125.808 1.643 . . . . 0.0 109.555 -177.548 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 592' ' ' VAL . . . . . . . . . . . . . 6.9 m . . . . . 0 CA--C 1.552 1.034 0 C-N-CA 124.854 1.262 . . . . 0.0 109.306 -177.211 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 70.5 Cg_endo . . . . . 0 CA--C 1.543 0.931 0 CA-C-O 121.844 0.685 . . . . 0.0 113.405 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 15.6 t -124.75 137.88 55.96 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 C-N-CA 125.159 1.384 . . . . 0.0 111.924 175.476 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -68.44 143.27 95.28 Favored Pre-proline 0 CA--C 1.554 1.112 0 O-C-N 121.537 -0.727 . . . . 0.0 112.631 179.086 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 26.6 Cg_endo -76.87 164.52 29.84 Favored 'Trans proline' 0 CA--C 1.548 1.2 0 C-N-CA 122.893 2.395 . . . . 0.0 113.51 177.221 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo . . . . . 0 CA--C 1.541 0.849 0 C-N-CA 123.455 2.77 . . . . 0.0 112.131 176.44 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 11.7 mt . . . . . 0 CA--C 1.553 1.093 0 CA-C-O 120.196 0.046 . . . . 0.0 111.069 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -67.97 160.07 50.15 Favored 'Trans proline' 0 CA--C 1.541 0.842 0 C-N-CA 123.671 2.914 . . . . 0.0 113.222 -177.078 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -62.61 134.15 46.12 Favored 'Trans proline' 0 CA--C 1.535 0.562 0 C-N-CA 123.05 2.5 . . . . 0.0 111.037 -177.598 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 74.42 -2.1 47.7 Favored Glycine 0 CA--C 1.535 1.337 0 CA-C-O 117.628 -1.651 . . . . 0.0 115.751 -178.675 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 31.3 t80 -31.69 123.7 0.27 Allowed 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 117.827 2.528 . . . . 0.0 117.827 -176.795 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 46.2 mtm -94.81 -53.1 3.98 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 112.413 0.523 . . . . 0.0 112.413 -176.095 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 523' ' ' PHE . . . . . . . . . . . . . 28.1 p90 -169.55 174.26 5.99 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 126.556 1.943 . . . . 0.0 112.872 -173.591 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 524' ' ' LYS . . . . . 0.434 ' HE2' ' CD2' ' A' ' 548' ' ' LEU . 50.9 mttt -106.58 163.81 12.58 Favored 'General case' 0 N--CA 1.47 0.543 0 O-C-N 120.818 -1.176 . . . . 0.0 112.653 169.207 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 12.5 m -133.3 160.91 42.16 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.925 0 C-N-CA 126.626 1.97 . . . . 0.0 110.065 165.413 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 25.6 tt0 -124.5 127.37 47.35 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 119.709 1.14 . . . . 0.0 112.919 172.733 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 527' ' ' ALA . . . . . . . . . . . . . . . -64.6 123.71 19.98 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.618 1.167 . . . . 0.0 112.738 -178.45 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 35.5 mm-40 -89.68 -25.35 21.27 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 125.426 1.49 . . . . 0.0 111.87 175.276 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 94.3 m-70 -138.62 164.66 28.91 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 127.745 2.418 . . . . 0.0 110.121 179.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -87.73 138.64 31.29 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 107.092 -1.447 . . . . 0.0 107.092 177.098 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 66.9 t80 -127.43 115.74 19.38 Favored 'General case' 0 C--N 1.332 -0.187 0 C-N-CA 125.586 1.555 . . . . 0.0 113.648 -179.194 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -84.15 128.45 34.57 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 114.722 1.379 . . . . 0.0 114.722 -177.56 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -72.11 108.64 5.41 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 121.778 0.799 . . . . 0.0 111.139 -179.309 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 12.3 t -80.53 -17.97 49.91 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 114.388 1.255 . . . . 0.0 114.388 -177.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 24.8 m-20 -148.57 168.84 21.71 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 127.205 2.202 . . . . 0.0 114.9 -171.262 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 2.0 t -61.06 -34.78 75.43 Favored 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 117.012 2.227 . . . . 0.0 117.012 -173.284 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 45.3 m-20 -81.34 -15.21 56.04 Favored 'General case' 0 CA--C 1.539 0.558 0 N-CA-C 114.971 1.471 . . . . 0.0 114.971 177.643 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 24.3 mp0 -83.71 134.37 34.76 Favored 'General case' 0 CA--C 1.543 0.707 0 O-C-N 120.873 -1.142 . . . . 0.0 113.849 -166.412 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -83.9 128.63 34.68 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.922 1.689 . . . . 0.0 110.442 178.93 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 8.6 tt0 -90.1 132.41 35.44 Favored 'General case' 0 CA--C 1.537 0.48 0 O-C-N 121.667 -0.645 . . . . 0.0 111.932 177.827 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 73.1 mt -123.68 146.43 48.24 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.722 1.209 . . . . 0.0 112.643 -174.741 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -114.3 141.17 47.93 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 125.05 1.34 . . . . 0.0 110.126 170.272 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -56.2 104.91 0.16 Allowed 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 123.75 0.82 . . . . 0.0 111.895 179.622 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 125.38 -12.74 7.48 Favored Glycine 0 CA--C 1.532 1.147 0 C-N-CA 126.616 2.055 . . . . 0.0 114.296 -174.161 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 90.0 m-20 -74.14 125.43 28.33 Favored 'General case' 0 C--O 1.231 0.12 0 N-CA-C 115.227 1.565 . . . . 0.0 115.227 -173.183 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 2.6 t -73.85 134.33 29.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 C-N-CA 122.921 0.488 . . . . 0.0 111.394 167.041 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 1.4 t -121.92 121.6 64.59 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.593 0 C-N-CA 124.9 1.28 . . . . 0.0 111.308 174.108 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 548' ' ' LEU . . . . . 0.434 ' CD2' ' HE2' ' A' ' 524' ' ' LYS . 18.3 mt -77.17 100.22 5.7 Favored 'General case' 0 CA--C 1.539 0.525 0 N-CA-C 108.055 -1.091 . . . . 0.0 108.055 175.895 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 549' ' ' VAL . . . . . . . . . . . . . 4.1 t -62.03 129.31 24.96 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.92 0 N-CA-C 113.652 0.982 . . . . 0.0 113.652 171.572 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 8.3 pt -123.69 154.67 66.9 Favored Pre-proline 0 CA--C 1.54 0.592 0 C-N-CA 125.965 1.706 . . . . 0.0 109.447 179.581 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -65.39 142.28 71.71 Favored 'Trans proline' 0 N--CA 1.458 -0.593 0 C-N-CA 122.711 2.274 . . . . 0.0 110.026 174.686 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 34.5 m-85 . . . . . 0 C--O 1.235 0.335 0 N-CA-C 116.807 2.151 . . . . 0.0 116.807 -175.555 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 49.1 tt0 . . . . . 0 CA--C 1.538 0.497 0 N-CA-C 111.988 0.366 . . . . 0.0 111.988 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -114.73 149.77 36.34 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 126.189 1.795 . . . . 0.0 113.083 171.517 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 57.0 tt0 -69.9 122.99 20.37 Favored 'General case' 0 CA--C 1.538 0.49 0 O-C-N 121.142 -0.974 . . . . 0.0 111.436 -173.493 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 85.43 -2.23 88.13 Favored Glycine 0 CA--C 1.535 1.343 0 C-N-CA 125.059 1.314 . . . . 0.0 115.059 -176.519 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 59.1 m95 -95.08 154.1 17.34 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 126.025 1.73 . . . . 0.0 112.643 174.008 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 13.1 mt -131.04 159.73 36.68 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 123.18 0.592 . . . . 0.0 111.161 168.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 48.3 ttm -117.27 139.55 50.67 Favored 'General case' 0 CA--C 1.527 0.091 0 C-N-CA 125.384 1.474 . . . . 0.0 110.712 -179.668 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -170.37 -175.75 39.39 Favored Glycine 0 CA--C 1.523 0.584 0 C-N-CA 123.943 0.783 . . . . 0.0 112.49 -178.896 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 14.9 p -128.04 138.82 53.61 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.444 0 C-N-CA 125.406 1.482 . . . . 0.0 108.578 169.526 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 38.7 mtmt -58.09 134.43 56.43 Favored 'General case' 0 N--CA 1.465 0.307 0 O-C-N 121.377 -0.827 . . . . 0.0 110.559 176.198 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -58.92 -42.99 91.0 Favored 'General case' 0 C--O 1.22 -0.469 0 CA-C-O 118.773 -0.632 . . . . 0.0 109.749 175.552 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 57.4 p -60.0 -22.59 62.77 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 115.508 1.67 . . . . 0.0 115.508 174.074 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 53.9 m-20 -85.13 -45.31 12.19 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.962 1.305 . . . . 0.0 114.219 173.862 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 59.4 t-105 -67.57 -35.86 79.84 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.323 1.449 . . . . 0.0 112.826 174.857 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 9.7 t-20 -77.7 -14.44 59.61 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 126.21 1.804 . . . . 0.0 112.852 175.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 57.4 mm-40 -90.81 0.46 57.45 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 125.198 1.399 . . . . 0.0 112.666 162.106 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 93.6 m-70 59.58 34.85 22.46 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 127.871 2.468 . . . . 0.0 114.044 175.894 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 6.6 mtpm? -74.45 147.78 41.68 Favored 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 125.217 1.407 . . . . 0.0 110.659 177.806 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 6.7 pm0 -51.94 103.58 0.07 Allowed 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 126.585 1.954 . . . . 0.0 114.505 -175.397 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 57.5 tp -51.38 -49.63 61.14 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 126.236 1.814 . . . . 0.0 113.27 -171.713 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 92.6 mt-10 -66.02 -13.43 59.91 Favored 'General case' 0 CA--C 1.546 0.805 0 N-CA-C 114.154 1.168 . . . . 0.0 114.154 -175.757 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 33.5 mmtp -106.7 -30.13 9.16 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 125.381 1.472 . . . . 0.0 112.963 171.818 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 84.0 m -82.9 -23.04 33.75 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 114.221 1.193 . . . . 0.0 114.221 -176.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 40.3 ptt180 -63.64 162.61 12.77 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.907 1.283 . . . . 0.0 112.753 173.287 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -175.43 176.21 47.31 Favored Glycine 0 CA--C 1.529 0.929 0 CA-C-N 115.282 -0.872 . . . . 0.0 115.132 170.525 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 34.1 m -93.36 140.88 15.61 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 C-N-CA 124.819 1.247 . . . . 0.0 112.242 169.482 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 50.8 p90 -140.37 155.92 69.88 Favored Pre-proline 0 CA--C 1.544 0.721 0 C-N-CA 125.259 1.423 . . . . 0.0 112.484 176.738 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_endo -71.11 112.37 3.29 Favored 'Trans proline' 0 CA--C 1.533 0.467 0 C-N-CA 122.535 2.157 . . . . 0.0 109.667 171.158 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 20.2 pt-20 -57.56 -26.06 60.88 Favored 'General case' 0 N--CA 1.476 0.871 0 O-C-N 121.286 -0.884 . . . . 0.0 112.441 179.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 10.1 p-10 -71.75 -10.72 60.19 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 125.683 1.593 . . . . 0.0 114.859 177.268 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 18.6 m-85 -75.65 -13.83 60.34 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 117.003 2.223 . . . . 0.0 117.003 160.051 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 589' ' ' THR . . . . . . . . . . . . . 73.4 p -122.13 175.8 6.17 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 126.339 1.856 . . . . 0.0 110.477 -175.91 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -124.59 137.78 54.37 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 124.145 0.978 . . . . 0.0 108.803 170.003 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.67 125.56 27.78 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 123.742 0.817 . . . . 0.0 109.151 179.666 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 592' ' ' VAL . . . . . . . . . . . . . 7.1 m . . . . . 0 N--CA 1.479 1.022 0 C-N-CA 124.911 1.284 . . . . 0.0 109.774 -175.586 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo . . . . . 0 CA--C 1.54 0.8 0 CA-C-O 121.551 0.563 . . . . 0.0 112.784 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 4.1 t -135.44 135.14 51.97 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 C-N-CA 124.978 1.311 . . . . 0.0 112.83 178.631 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -61.62 136.63 94.69 Favored Pre-proline 0 CA--C 1.554 1.127 0 O-C-N 121.636 -0.665 . . . . 0.0 112.253 178.321 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -71.52 168.08 24.58 Favored 'Trans proline' 0 CA--C 1.543 0.972 0 C-N-CA 123.305 2.67 . . . . 0.0 111.586 171.712 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo . . . . . 0 CA--C 1.542 0.889 0 C-N-CA 122.739 2.293 . . . . 0.0 113.211 -179.564 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 10.5 mt . . . . . 0 CA--C 1.551 0.99 0 N-CA-C 111.945 0.35 . . . . 0.0 111.945 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -69.27 161.35 46.24 Favored 'Trans proline' 0 CA--C 1.537 0.648 0 C-N-CA 124.02 3.146 . . . . 0.0 113.782 -175.643 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 65.8 Cg_endo -61.87 142.06 92.04 Favored 'Trans proline' 0 N--CA 1.458 -0.569 0 C-N-CA 122.732 2.288 . . . . 0.0 110.283 178.139 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 67.37 3.56 26.03 Favored Glycine 0 CA--C 1.533 1.186 0 CA-C-O 117.198 -1.89 . . . . 0.0 116.177 -178.369 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 27.9 t80 -40.56 137.28 1.15 Allowed 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 116.886 2.18 . . . . 0.0 116.886 -178.119 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 57.1 mtm -112.91 -53.87 2.67 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 113.435 0.902 . . . . 0.0 113.435 -174.748 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 523' ' ' PHE . . . . . . . . . . . . . 26.1 p90 -167.36 174.32 8.12 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 126.612 1.965 . . . . 0.0 111.389 -178.205 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 524' ' ' LYS . . . . . 0.475 ' HE2' ' CD2' ' A' ' 548' ' ' LEU . 78.1 mttt -109.41 161.95 14.82 Favored 'General case' 0 N--CA 1.467 0.414 0 O-C-N 121.413 -0.804 . . . . 0.0 111.226 171.759 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 5.6 m -130.23 163.83 34.74 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 C-N-CA 126.261 1.824 . . . . 0.0 110.202 165.411 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 60.8 tt0 -129.52 130.81 46.26 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 118.836 0.744 . . . . 0.0 112.694 169.586 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 527' ' ' ALA . . . . . . . . . . . . . . . -64.07 119.14 9.58 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.604 1.162 . . . . 0.0 112.335 -178.06 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 46.9 mm-40 -86.13 -22.23 27.18 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.229 1.411 . . . . 0.0 111.417 171.762 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 89.1 m-70 -140.87 157.69 45.02 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 126.404 1.882 . . . . 0.0 110.455 178.033 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -84.77 141.79 30.27 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 -178.656 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 76.9 t80 -136.45 120.7 17.91 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 125.895 1.678 . . . . 0.0 112.306 -179.532 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 1.9 m -90.37 132.78 35.4 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 114.01 1.115 . . . . 0.0 114.01 175.233 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -67.36 128.45 36.44 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-O 121.588 0.709 . . . . 0.0 112.186 -176.655 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 1.7 p -107.19 -3.64 19.62 Favored 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 116.743 2.127 . . . . 0.0 116.743 -177.647 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 34.9 t0 -143.87 165.78 26.77 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 124.799 1.24 . . . . 0.0 108.984 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 1.5 t -55.83 -35.51 66.46 Favored 'General case' 0 N--CA 1.464 0.271 0 N-CA-C 114.673 1.36 . . . . 0.0 114.673 167.081 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 90.2 m-20 -68.06 -22.71 64.93 Favored 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 117.093 2.257 . . . . 0.0 117.093 176.25 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -88.2 144.8 26.24 Favored 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 115.398 1.629 . . . . 0.0 115.398 -163.137 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -90.28 139.89 30.22 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 127.326 2.25 . . . . 0.0 109.82 177.552 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 15.9 tt0 -91.63 131.13 37.25 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.801 0.84 . . . . 0.0 110.559 171.393 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 80.5 mt -124.89 136.94 54.25 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 124.998 1.319 . . . . 0.0 111.961 -179.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 3.3 tppp? -96.27 141.72 29.27 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 125.873 1.669 . . . . 0.0 110.495 163.614 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -57.25 107.73 0.45 Allowed 'General case' 0 CA--C 1.545 0.752 0 CA-C-N 119.281 0.946 . . . . 0.0 109.907 170.163 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 122.46 -11.06 9.11 Favored Glycine 0 CA--C 1.537 1.437 0 C-N-CA 126.546 2.022 . . . . 0.0 114.592 -172.191 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 74.6 m-20 -71.85 124.86 25.75 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 119.835 1.818 . . . . 0.0 115.72 -178.029 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 16.7 t -74.89 133.25 31.88 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 C-N-CA 123.232 0.613 . . . . 0.0 110.369 164.382 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -125.48 122.15 61.92 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.443 0 C-N-CA 125.011 1.324 . . . . 0.0 111.136 175.84 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 548' ' ' LEU . . . . . 0.475 ' CD2' ' HE2' ' A' ' 524' ' ' LYS . 20.8 mt -79.93 103.45 9.82 Favored 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 108.149 -1.056 . . . . 0.0 108.149 177.643 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 549' ' ' VAL . . . . . . . . . . . . . 4.0 t -62.32 126.32 20.33 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.083 0 N-CA-C 113.499 0.926 . . . . 0.0 113.499 172.204 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 20.5 pt -126.43 159.8 61.23 Favored Pre-proline 0 N--CA 1.474 0.744 0 C-N-CA 126.978 2.111 . . . . 0.0 108.94 179.219 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo -72.54 149.74 50.14 Favored 'Trans proline' 0 N--CA 1.456 -0.711 0 C-N-CA 122.948 2.432 . . . . 0.0 112.303 175.362 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 72.0 m-85 . . . . . 0 CA--C 1.533 0.313 0 N-CA-C 113.526 0.936 . . . . 0.0 113.526 167.775 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 54.6 tt0 . . . . . 0 CA--C 1.533 0.31 0 N-CA-C 112.62 0.6 . . . . 0.0 112.62 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 72.5 m-20 -103.99 145.72 29.74 Favored 'General case' 0 CA--C 1.554 1.135 0 C-N-CA 125.684 1.594 . . . . 0.0 113.066 -176.937 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 72.5 tt0 -76.87 107.53 9.26 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 124.786 1.234 . . . . 0.0 112.938 -169.406 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 96.11 1.29 61.27 Favored Glycine 0 CA--C 1.537 1.419 0 C-N-CA 125.072 1.32 . . . . 0.0 114.392 -174.745 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 53.5 m95 -93.53 169.48 10.31 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 126.344 1.857 . . . . 0.0 113.31 176.67 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 16.6 mt -141.38 153.22 44.95 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 125.488 1.515 . . . . 0.0 110.39 165.787 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 57.5 ttm -105.25 142.52 34.87 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 125.396 1.479 . . . . 0.0 112.262 170.575 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -165.24 -174.83 35.31 Favored Glycine 0 CA--C 1.527 0.788 0 C-N-CA 124.946 1.26 . . . . 0.0 112.795 174.566 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 12.7 p -128.92 139.99 50.43 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 C-N-CA 125.127 1.371 . . . . 0.0 109.321 169.777 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 34.9 mtmt -58.02 135.59 56.99 Favored 'General case' 0 N--CA 1.468 0.435 0 O-C-N 121.538 -0.726 . . . . 0.0 110.814 175.407 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -59.22 -38.88 81.05 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-O 118.159 -0.924 . . . . 0.0 111.215 176.768 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 8.7 t -71.77 -32.65 67.9 Favored 'General case' 0 N--CA 1.477 0.89 0 CA-C-N 119.912 1.233 . . . . 0.0 111.782 -179.175 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 71.2 m-20 -61.59 -50.19 73.62 Favored 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 113.669 0.989 . . . . 0.0 113.669 167.751 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 49.8 t-105 -68.04 -33.36 74.42 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 114.305 1.224 . . . . 0.0 114.305 -179.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 8.4 t-20 -68.17 -30.16 69.2 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.591 1.157 . . . . 0.0 111.919 178.292 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 41.6 mt-30 -78.3 3.47 15.42 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.489 1.116 . . . . 0.0 112.984 170.764 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 26.0 m-70 61.15 31.46 19.63 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 126.538 1.935 . . . . 0.0 112.897 179.573 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 20.9 mttm -65.11 154.7 37.15 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 123.883 0.873 . . . . 0.0 112.807 179.819 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 576' ' ' GLU . . . . . 0.414 ' HG2' ' HG ' ' A' ' 580' ' ' CYS . 9.1 pm0 -53.18 104.74 0.1 Allowed 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 126.152 1.781 . . . . 0.0 112.892 179.573 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 58.2 tp -64.02 -50.08 69.85 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 124.488 1.115 . . . . 0.0 111.917 -166.299 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 16.1 pm0 -61.39 -22.8 65.31 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.285 1.034 . . . . 0.0 113.778 -178.149 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 23.4 tptm -88.46 -55.27 3.79 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 126.062 1.745 . . . . 0.0 111.195 175.124 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 580' ' ' CYS . . . . . 0.414 ' HG ' ' HG2' ' A' ' 576' ' ' GLU . 87.8 m -75.0 -19.63 60.0 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 125.155 1.382 . . . . 0.0 114.694 -168.98 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 19.9 ptt180 -64.03 160.47 17.94 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 123.649 0.78 . . . . 0.0 111.61 170.202 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -166.21 172.33 41.5 Favored Glycine 0 CA--C 1.525 0.709 0 CA-C-N 115.142 -0.936 . . . . 0.0 113.158 173.302 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 22.7 m -91.61 145.53 7.39 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.34 0 C-N-CA 124.427 1.091 . . . . 0.0 111.245 168.853 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 47.4 p90 -140.57 155.5 69.63 Favored Pre-proline 0 C--O 1.24 0.6 0 C-N-CA 124.82 1.248 . . . . 0.0 112.664 176.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -67.95 109.41 1.92 Allowed 'Trans proline' 0 N--CA 1.457 -0.623 0 C-N-CA 122.0 1.8 . . . . 0.0 109.62 170.503 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 19.2 pt-20 -54.47 -28.02 41.68 Favored 'General case' 0 N--CA 1.476 0.844 0 O-C-N 121.215 -0.928 . . . . 0.0 112.386 -179.627 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 11.6 p-10 -69.07 -13.59 62.53 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 126.143 1.777 . . . . 0.0 114.361 177.554 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 15.0 m-85 -74.39 -12.83 60.62 Favored 'General case' 0 N--CA 1.467 0.382 0 N-CA-C 116.802 2.149 . . . . 0.0 116.802 163.561 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 589' ' ' THR . . . . . . . . . . . . . 73.4 p -123.99 173.99 7.88 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 125.404 1.482 . . . . 0.0 111.679 -172.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -119.89 140.99 50.0 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.746 1.218 . . . . 0.0 108.942 169.726 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 15.0 tpt180 -67.44 105.72 1.9 Allowed 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.496 1.119 . . . . 0.0 108.959 171.545 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 592' ' ' VAL . . . . . . . . . . . . . 2.1 m . . . . . 0 CA--C 1.541 0.633 0 C-N-CA 123.637 0.775 . . . . 0.0 109.275 178.963 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo . . . . . 0 CA--C 1.542 0.912 0 N-CA-C 114.039 0.746 . . . . 0.0 114.039 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 29.7 t -133.85 131.51 56.35 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 125.63 1.572 . . . . 0.0 111.429 -179.622 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -65.62 139.47 97.11 Favored Pre-proline 0 CA--C 1.552 1.039 0 O-C-N 121.439 -0.788 . . . . 0.0 112.361 -179.047 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo -75.13 164.94 32.15 Favored 'Trans proline' 0 CA--C 1.547 1.152 0 C-N-CA 123.186 2.59 . . . . 0.0 112.62 175.709 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo . . . . . 0 CA--C 1.541 0.86 0 C-N-CA 123.67 2.913 . . . . 0.0 114.223 174.888 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 14.1 mt . . . . . 0 CA--C 1.545 0.77 0 N-CA-C 111.818 0.303 . . . . 0.0 111.818 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -68.45 159.26 54.18 Favored 'Trans proline' 0 CA--C 1.539 0.771 0 C-N-CA 123.957 3.105 . . . . 0.0 113.38 -172.734 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -61.89 128.42 24.24 Favored 'Trans proline' 0 N--CA 1.459 -0.536 0 C-N-CA 123.218 2.612 . . . . 0.0 111.321 -174.759 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 73.48 5.47 67.85 Favored Glycine 0 CA--C 1.537 1.446 0 CA-C-O 116.865 -2.075 . . . . 0.0 115.805 -177.177 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 22.2 t80 -35.67 133.96 0.37 Allowed 'General case' 0 N--CA 1.471 0.608 0 CA-C-N 120.508 2.154 . . . . 0.0 116.52 177.254 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 53.3 mtm -107.08 -57.45 2.07 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 123.541 0.736 . . . . 0.0 111.701 -177.301 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 523' ' ' PHE . . . . . . . . . . . . . 25.8 p90 -160.25 169.66 22.75 Favored 'General case' 0 C--O 1.222 -0.366 0 C-N-CA 125.168 1.387 . . . . 0.0 114.142 -174.571 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 524' ' ' LYS . . . . . 0.424 ' HE2' ' CD2' ' A' ' 548' ' ' LEU . 85.3 mttt -102.6 164.19 11.79 Favored 'General case' 0 CA--C 1.538 0.485 0 O-C-N 121.118 -0.989 . . . . 0.0 112.272 168.056 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 10.2 m -136.32 159.49 38.34 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 C-N-CA 127.051 2.14 . . . . 0.0 109.546 165.109 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 45.0 tt0 -123.58 128.57 49.89 Favored 'General case' 0 N--CA 1.475 0.779 0 CA-C-N 119.323 0.965 . . . . 0.0 112.213 168.755 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 527' ' ' ALA . . . . . . . . . . . . . . . -64.03 122.61 16.95 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.103 0.961 . . . . 0.0 112.313 -179.275 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 48.5 mm-40 -88.23 -23.18 23.61 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.497 1.519 . . . . 0.0 111.867 174.514 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 93.8 m-70 -139.65 157.74 45.27 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 126.984 2.114 . . . . 0.0 110.206 -175.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 34.8 p-10 -87.19 135.65 33.22 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 119.374 0.988 . . . . 0.0 113.22 -179.503 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 83.0 t80 -128.63 110.03 11.87 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 124.6 1.16 . . . . 0.0 111.829 -178.332 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 532' ' ' THR . . . . . . . . . . . . 0.253 0.2 OUTLIER -82.91 113.91 20.84 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 114.148 1.166 . . . . 0.0 114.148 168.677 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -62.02 143.73 56.16 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 123.858 0.863 . . . . 0.0 112.186 175.43 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 534' ' ' THR . . . . . . . . . . . . 0.27 4.6 t -126.23 21.96 7.27 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 127.233 2.213 . . . . 0.0 114.36 179.496 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 38.7 t0 -152.63 156.24 38.88 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 107.565 -1.272 . . . . 0.0 107.565 165.764 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 5.0 t -68.17 -10.39 53.92 Favored 'General case' 0 N--CA 1.476 0.86 0 N-CA-C 114.956 1.465 . . . . 0.0 114.956 167.33 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 39.7 t0 -77.55 -31.03 53.02 Favored 'General case' 0 CA--C 1.553 1.07 0 C-N-CA 125.506 1.523 . . . . 0.0 110.989 167.037 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 82.8 mt-10 -81.52 147.16 29.81 Favored 'General case' 0 CA--C 1.547 0.835 0 O-C-N 120.265 -1.522 . . . . 0.0 113.67 -175.779 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -93.14 139.04 31.01 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 127.068 2.147 . . . . 0.0 110.31 176.027 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 15.6 tt0 -94.72 129.91 41.44 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.408 1.083 . . . . 0.0 111.574 179.423 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 76.7 mt -128.56 148.7 50.78 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.699 1.2 . . . . 0.0 112.86 -176.023 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 12.5 tmtt? -120.41 148.13 44.17 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 126.32 1.848 . . . . 0.0 109.841 169.766 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -56.29 99.5 0.03 OUTLIER 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 123.735 0.814 . . . . 0.0 111.856 174.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 127.73 -4.59 7.03 Favored Glycine 0 CA--C 1.537 1.456 0 C-N-CA 126.659 2.076 . . . . 0.0 114.304 -176.282 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 81.6 m-20 -79.33 120.88 24.4 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 119.395 1.597 . . . . 0.0 113.648 -176.018 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 36.6 t -74.49 135.01 28.33 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 CA-C-N 119.138 0.881 . . . . 0.0 110.15 168.695 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -123.1 122.21 64.96 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.508 0 C-N-CA 125.651 1.58 . . . . 0.0 111.496 174.549 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 548' ' ' LEU . . . . . 0.424 ' CD2' ' HE2' ' A' ' 524' ' ' LYS . 42.4 mt -78.44 101.2 7.18 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.457 1.103 . . . . 0.0 108.318 175.279 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 549' ' ' VAL . . . . . . . . . . . . . 4.4 t -63.97 131.49 29.62 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.337 0 N-CA-C 114.844 1.424 . . . . 0.0 114.844 173.313 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 15.8 pt -131.93 154.76 81.84 Favored Pre-proline 0 CA--C 1.548 0.903 0 C-N-CA 126.383 1.873 . . . . 0.0 111.28 -178.78 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -72.81 149.18 47.56 Favored 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 124.321 3.347 . . . . 0.0 111.785 173.597 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 63.6 m-85 . . . . . 0 CA--C 1.539 0.543 0 N-CA-C 114.897 1.443 . . . . 0.0 114.897 -178.656 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 39.9 tt0 . . . . . 0 CA--C 1.537 0.469 0 N-CA-C 114.152 1.167 . . . . 0.0 114.152 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 54.5 m-20 -93.36 150.25 20.61 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 126.183 1.793 . . . . 0.0 111.726 174.677 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 30.7 tp10 -80.8 127.99 33.15 Favored 'General case' 0 N--CA 1.474 0.726 0 O-C-N 120.968 -1.083 . . . . 0.0 110.895 -177.334 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 83.88 4.9 88.4 Favored Glycine 0 CA--C 1.538 1.501 0 O-C-N 121.327 -0.858 . . . . 0.0 114.705 -173.153 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 50.2 m95 -110.74 157.38 19.83 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 127.019 2.128 . . . . 0.0 112.598 178.401 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 11.5 mt -133.15 153.74 51.25 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 123.286 0.634 . . . . 0.0 110.992 173.564 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 41.9 ttm -106.37 142.76 35.51 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 123.997 0.919 . . . . 0.0 112.136 177.123 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -165.25 -170.34 30.07 Favored Glycine 0 CA--C 1.525 0.697 0 C-N-CA 124.282 0.944 . . . . 0.0 112.309 173.69 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 14.3 p -134.41 140.7 45.34 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.502 0 C-N-CA 125.966 1.707 . . . . 0.0 108.993 170.884 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 41.7 mtmt -62.42 134.76 56.89 Favored 'General case' 0 N--CA 1.465 0.304 0 O-C-N 121.139 -0.976 . . . . 0.0 112.064 176.636 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -57.36 -43.06 83.2 Favored 'General case' 0 C--O 1.222 -0.375 0 CA-C-O 118.12 -0.943 . . . . 0.0 111.391 -177.006 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 33.2 t -62.62 -33.1 74.32 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 119.358 0.981 . . . . 0.0 113.529 -178.849 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -69.69 -45.95 67.12 Favored 'General case' 0 CA--C 1.542 0.672 0 O-C-N 120.835 -1.166 . . . . 0.0 108.812 176.19 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 66.1 t-105 -66.72 -36.3 82.16 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 124.329 1.052 . . . . 0.0 112.525 179.49 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -67.78 -31.27 71.04 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 126.288 1.835 . . . . 0.0 111.783 175.213 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 44.1 mt-30 -77.09 -0.63 25.48 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.609 1.164 . . . . 0.0 113.73 172.287 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 67.0 m-70 68.37 18.85 9.05 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 127.99 2.516 . . . . 0.0 115.119 -178.406 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 6.7 mtpm? -76.34 160.71 29.35 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 125.233 1.413 . . . . 0.0 112.987 -173.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 18.1 pm0 -58.72 127.29 31.43 Favored 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 114.189 1.181 . . . . 0.0 114.189 -175.059 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 62.0 tp -75.31 -45.81 37.3 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 125.405 1.482 . . . . 0.0 111.891 -173.622 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 23.9 pt-20 -62.81 -18.33 62.61 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 113.856 1.058 . . . . 0.0 113.856 -174.506 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 4.2 tppp? -95.07 -41.57 9.05 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 126.065 1.746 . . . . 0.0 113.715 176.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 48.3 t -78.25 -28.18 47.7 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 118.568 0.622 . . . . 0.0 112.479 -179.796 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 50.7 ptt85 -54.08 149.47 9.35 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-O 121.74 0.781 . . . . 0.0 112.382 -179.74 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -172.47 170.73 43.77 Favored Glycine 0 N--CA 1.462 0.427 0 CA-C-N 115.358 -0.837 . . . . 0.0 114.348 177.025 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 17.6 m -91.91 136.78 23.59 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.252 0 C-N-CA 124.782 1.233 . . . . 0.0 111.43 171.854 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 44.6 p90 -132.57 154.79 81.65 Favored Pre-proline 0 CA--C 1.539 0.536 0 C-N-CA 124.358 1.063 . . . . 0.0 112.968 175.711 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -68.46 110.78 2.36 Favored 'Trans proline' 0 N--CA 1.457 -0.655 0 C-N-CA 122.262 1.975 . . . . 0.0 110.02 169.702 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 21.3 pt-20 -55.79 -29.49 59.77 Favored 'General case' 0 CA--C 1.547 0.855 0 O-C-N 121.416 -0.802 . . . . 0.0 112.233 -179.832 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 9.7 p-10 -67.22 -8.7 33.55 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 126.141 1.776 . . . . 0.0 114.523 179.446 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 17.1 m-85 -82.68 -11.9 58.0 Favored 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 116.783 2.142 . . . . 0.0 116.783 166.622 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 589' ' ' THR . . . . . . . . . . . . . 60.4 p -122.77 173.23 7.88 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 125.511 1.525 . . . . 0.0 111.528 -171.881 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -124.14 139.45 53.91 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.061 0.945 . . . . 0.0 108.997 170.13 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.82 136.23 57.25 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 125.149 1.379 . . . . 0.0 109.127 177.225 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 592' ' ' VAL . . . . . . . . . . . . . 2.4 m . . . . . 0 N--CA 1.481 1.115 0 C-N-CA 124.78 1.232 . . . . 0.0 109.486 177.783 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo . . . . . 0 CA--C 1.542 0.879 0 CA-C-O 121.095 0.373 . . . . 0.0 112.966 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 2.9 t -132.49 138.86 51.24 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 C-N-CA 125.777 1.631 . . . . 0.0 112.96 178.869 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -72.63 139.7 80.99 Favored Pre-proline 0 CA--C 1.555 1.135 0 O-C-N 120.763 -1.211 . . . . 0.0 112.759 -176.558 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo -76.23 165.45 29.45 Favored 'Trans proline' 0 CA--C 1.553 1.428 0 C-N-CA 123.049 2.5 . . . . 0.0 114.181 -177.442 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 34.5 Cg_exo . . . . . 0 C--N 1.351 0.703 0 C-N-CA 123.999 3.133 . . . . 0.0 114.207 179.723 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 14.9 mt . . . . . 0 CA--C 1.551 0.992 0 N-CA-C 112.605 0.595 . . . . 0.0 112.605 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_endo -67.8 162.14 40.86 Favored 'Trans proline' 0 CA--C 1.539 0.775 0 C-N-CA 123.755 2.97 . . . . 0.0 114.055 -176.056 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -64.11 138.67 63.0 Favored 'Trans proline' 0 C--N 1.348 0.546 0 C-N-CA 122.78 2.32 . . . . 0.0 109.89 176.348 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 70.58 4.72 53.69 Favored Glycine 0 CA--C 1.532 1.114 0 CA-C-O 117.638 -1.646 . . . . 0.0 115.69 -176.016 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 48.8 t80 -44.72 129.87 7.03 Favored 'General case' 0 C--O 1.238 0.494 0 CA-C-N 120.82 2.31 . . . . 0.0 115.216 179.697 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 60.1 mtm -105.36 -59.09 1.81 Allowed 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 123.883 0.873 . . . . 0.0 111.932 -179.151 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 523' ' ' PHE . . . . . 0.525 ' CD1' ' HD3' ' A' ' 591' ' ' ARG . 32.5 p90 -160.34 175.45 12.82 Favored 'General case' 0 C--O 1.224 -0.252 0 C-N-CA 126.155 1.782 . . . . 0.0 112.406 -175.555 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 81.3 mttt -106.51 164.09 12.34 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 121.023 -1.048 . . . . 0.0 112.65 171.332 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 12.0 m -131.62 160.94 42.02 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 C-N-CA 126.145 1.778 . . . . 0.0 109.552 164.377 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 45.2 tt0 -122.19 128.03 50.72 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 118.613 0.642 . . . . 0.0 111.423 166.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 527' ' ' ALA . . . . . . . . . . . . . . . -56.63 123.35 14.55 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.241 1.016 . . . . 0.0 111.209 173.049 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 42.3 mm-40 -84.84 -27.45 26.74 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.153 1.381 . . . . 0.0 110.91 168.596 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 88.0 m-70 -139.34 160.18 40.43 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 127.065 2.146 . . . . 0.0 111.657 -174.23 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . 0.314 1.6 p30 -84.19 138.2 33.11 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 115.713 1.746 . . . . 0.0 115.713 178.932 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 89.3 t80 -138.25 128.33 25.69 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.609 1.564 . . . . 0.0 114.298 -176.147 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -90.8 128.2 36.62 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 124.7 1.2 . . . . 0.0 114.189 175.03 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -69.99 121.78 18.07 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 119.161 0.891 . . . . 0.0 110.822 173.032 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 12.2 t -88.51 -20.55 24.97 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 115.049 1.5 . . . . 0.0 115.049 -177.766 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 18.8 m-20 -145.18 177.5 8.75 Favored 'General case' 0 CA--C 1.554 1.11 0 N-CA-C 116.872 2.175 . . . . 0.0 116.872 -165.856 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 5.3 t -59.37 -17.81 33.28 Favored 'General case' 0 N--CA 1.481 1.09 0 N-CA-C 119.141 3.015 . . . . 0.0 119.141 -173.67 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . 0.287 18.8 m-20 -129.14 16.73 6.14 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 125.9 1.68 . . . . 0.0 115.18 175.776 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 20.0 mp0 -95.67 145.0 25.61 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.947 1.299 . . . . 0.0 112.797 -174.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -99.61 128.72 45.72 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 125.194 1.398 . . . . 0.0 111.538 -172.979 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 38.0 tt0 -84.64 124.95 32.04 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 124.843 1.257 . . . . 0.0 110.396 176.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 79.9 mt -125.12 145.99 49.68 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 124.925 1.29 . . . . 0.0 112.275 -178.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -115.11 143.73 44.75 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 125.817 1.647 . . . . 0.0 109.367 168.829 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -55.72 110.12 0.67 Allowed 'General case' 0 CA--C 1.545 0.777 0 CA-C-N 118.503 0.592 . . . . 0.0 110.705 179.736 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 115.78 -5.58 20.54 Favored Glycine 0 CA--C 1.538 1.488 0 C-N-CA 126.415 1.96 . . . . 0.0 114.618 -174.796 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 83.2 m-20 -72.82 124.64 25.79 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 115.794 1.775 . . . . 0.0 115.794 -176.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 41.7 t -72.84 133.71 31.22 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 C-N-CA 123.68 0.792 . . . . 0.0 110.156 169.116 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 1.5 t -128.07 123.66 60.99 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.328 0 C-N-CA 124.57 1.148 . . . . 0.0 111.527 174.301 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 30.1 mt -79.98 100.47 8.14 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.004 1.322 . . . . 0.0 108.55 177.465 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 549' ' ' VAL . . . . . . . . . . . . . 7.1 t -61.1 132.14 26.46 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.267 0 N-CA-C 114.924 1.453 . . . . 0.0 114.924 173.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 20.9 pt -129.99 157.45 76.9 Favored Pre-proline 0 CA--C 1.551 0.981 0 C-N-CA 127.098 2.159 . . . . 0.0 109.873 174.924 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -73.66 154.69 49.56 Favored 'Trans proline' 0 CA--C 1.536 0.601 0 C-N-CA 124.021 3.147 . . . . 0.0 112.094 174.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 36.8 m-85 . . . . . 0 CA--C 1.541 0.605 0 N-CA-C 117.195 2.294 . . . . 0.0 117.195 176.395 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 . . . . . 0 N--CA 1.467 0.386 0 N-CA-C 113.375 0.88 . . . . 0.0 113.375 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . 0.292 18.5 m-20 -96.6 140.03 31.81 Favored 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 116.554 2.057 . . . . 0.0 116.554 -179.175 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 54.9 tp10 -73.88 120.81 19.98 Favored 'General case' 0 CA--C 1.539 0.537 0 O-C-N 120.955 -1.091 . . . . 0.0 112.078 -173.563 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 87.82 3.12 80.63 Favored Glycine 0 CA--C 1.536 1.36 0 C-N-CA 124.514 1.054 . . . . 0.0 114.599 -172.68 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 57.1 m95 -100.98 164.52 11.78 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.569 1.548 . . . . 0.0 112.919 176.284 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 11.6 mt -137.77 152.4 49.13 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 124.943 1.297 . . . . 0.0 109.831 168.699 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 52.1 ttm -108.1 141.97 39.0 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 124.306 1.042 . . . . 0.0 111.503 172.516 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -169.85 -171.79 35.74 Favored Glycine 0 CA--C 1.526 0.767 0 C-N-CA 124.543 1.068 . . . . 0.0 112.666 176.188 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 14.7 p -132.65 138.54 51.79 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 C-N-CA 125.66 1.584 . . . . 0.0 108.893 171.085 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 37.9 mtmt -59.09 139.42 56.89 Favored 'General case' 0 N--CA 1.467 0.42 0 O-C-N 121.224 -0.922 . . . . 0.0 111.167 176.052 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 14.1 tt0 -60.0 -43.19 95.37 Favored 'General case' 0 C--O 1.222 -0.379 0 CA-C-O 119.008 -0.52 . . . . 0.0 110.742 176.524 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 76.4 p -60.05 -34.62 73.66 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 114.403 1.26 . . . . 0.0 114.403 176.467 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 40.9 m-20 -71.15 -45.84 62.71 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.281 1.432 . . . . 0.0 113.893 173.719 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 56.6 t-105 -71.46 -34.79 70.54 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 125.065 1.346 . . . . 0.0 113.834 178.332 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 33.6 t-20 -67.61 -21.81 65.39 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 125.586 1.554 . . . . 0.0 111.881 176.747 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 23.6 mm-40 -89.02 6.51 39.36 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.816 1.246 . . . . 0.0 114.279 169.411 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 2.2 m-70 61.92 23.57 13.89 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 125.79 1.636 . . . . 0.0 113.938 171.66 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 19.2 mtpp -74.56 168.48 19.68 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 125.931 1.693 . . . . 0.0 113.016 -175.774 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 8.3 pm0 -56.72 97.66 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.974 1.71 . . . . 0.0 113.327 -176.632 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 60.6 tp -54.23 -43.26 70.7 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.328 1.451 . . . . 0.0 111.906 -173.807 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -63.01 -33.85 76.31 Favored 'General case' 0 N--CA 1.476 0.859 0 N-CA-C 113.131 0.789 . . . . 0.0 113.131 -176.743 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 29.6 mmtp -88.49 -39.05 14.49 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 123.673 0.789 . . . . 0.0 112.511 175.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 93.6 m -71.83 -35.09 69.79 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 113.274 0.842 . . . . 0.0 113.274 -177.176 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.13 169.98 1.83 Allowed 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.174 0.99 . . . . 0.0 112.07 176.918 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -178.78 177.56 48.49 Favored Glycine 0 N--CA 1.45 -0.399 0 CA-C-N 114.606 -1.179 . . . . 0.0 114.414 166.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 19.3 m -88.88 141.61 14.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 C-N-CA 124.66 1.184 . . . . 0.0 111.542 166.227 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 39.8 p90 -136.5 154.06 76.55 Favored Pre-proline 0 CA--C 1.538 0.518 0 C-N-CA 125.395 1.478 . . . . 0.0 112.187 175.149 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -65.9 112.45 2.24 Favored 'Trans proline' 0 N--CA 1.46 -0.479 0 C-N-CA 121.788 1.659 . . . . 0.0 108.898 170.134 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 18.7 pt-20 -56.28 -30.8 62.96 Favored 'General case' 0 N--CA 1.471 0.604 0 O-C-N 121.346 -0.846 . . . . 0.0 111.459 -178.015 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 8.4 p-10 -63.49 -18.16 63.51 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 126.081 1.752 . . . . 0.0 113.914 178.667 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 9.5 m-85 -74.39 -13.97 60.8 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 116.125 1.898 . . . . 0.0 116.125 166.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 589' ' ' THR . . . . . . . . . . . . . 30.9 p -121.76 176.67 5.62 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 127.043 2.137 . . . . 0.0 112.199 -176.682 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 15.8 pt-20 -131.69 138.51 48.73 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.757 1.223 . . . . 0.0 109.808 168.476 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 591' ' ' ARG . . . . . 0.525 ' HD3' ' CD1' ' A' ' 523' ' ' PHE . 4.0 tpt180 -66.1 120.82 13.85 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 125.304 1.442 . . . . 0.0 111.294 176.252 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 592' ' ' VAL . . . . . . . . . . . . . 3.8 m . . . . . 0 N--CA 1.477 0.915 0 C-N-CA 125.241 1.416 . . . . 0.0 109.328 -178.154 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo . . . . . 0 CA--C 1.54 0.804 0 CA-C-O 121.493 0.539 . . . . 0.0 112.713 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 31.6 t -129.78 132.38 65.94 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 C-N-CA 125.73 1.612 . . . . 0.0 110.697 176.745 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -67.4 144.97 98.31 Favored Pre-proline 0 CA--C 1.549 0.939 0 N-CA-C 113.077 0.769 . . . . 0.0 113.077 -172.69 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -77.99 168.66 21.72 Favored 'Trans proline' 0 CA--C 1.548 1.183 0 C-N-CA 122.949 2.433 . . . . 0.0 112.391 175.35 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 77.8 Cg_exo . . . . . 0 CA--C 1.542 0.906 0 C-N-CA 123.719 2.946 . . . . 0.0 114.357 177.247 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 9.3 mt . . . . . 0 CA--C 1.541 0.632 0 CA-C-O 119.511 -0.281 . . . . 0.0 111.197 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 29.9 Cg_endo -67.89 157.44 61.79 Favored 'Trans proline' 0 CA--C 1.541 0.834 0 C-N-CA 123.362 2.708 . . . . 0.0 113.791 -171.209 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_endo -62.46 127.51 21.06 Favored 'Trans proline' 0 N--CA 1.459 -0.551 0 C-N-CA 123.584 2.856 . . . . 0.0 110.074 179.406 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 76.46 1.92 72.5 Favored Glycine 0 CA--C 1.532 1.155 0 CA-C-O 117.616 -1.658 . . . . 0.0 115.785 -175.711 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 30.1 t80 -36.78 128.28 0.85 Allowed 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 116.912 2.19 . . . . 0.0 116.912 178.013 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 52.3 mtm -100.11 -55.1 2.71 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 123.081 0.552 . . . . 0.0 112.178 -178.489 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 523' ' ' PHE . . . . . . . . . . . . . 24.6 p90 -165.62 170.38 14.27 Favored 'General case' 0 C--O 1.222 -0.345 0 C-N-CA 126.323 1.849 . . . . 0.0 112.654 -172.936 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 524' ' ' LYS . . . . . 0.51 ' HE2' ' CD2' ' A' ' 548' ' ' LEU . 78.5 mttt -102.18 162.9 12.56 Favored 'General case' 0 CA--C 1.538 0.483 0 O-C-N 121.169 -0.957 . . . . 0.0 111.807 169.298 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 17.7 m -136.24 160.98 38.08 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.904 0 C-N-CA 127.21 2.204 . . . . 0.0 108.788 166.19 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 41.3 tt0 -126.23 125.99 43.3 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 119.204 0.911 . . . . 0.0 111.587 175.347 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 527' ' ' ALA . . . . . . . . . . . . . . . -58.24 132.84 54.78 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 124.011 0.924 . . . . 0.0 111.391 -179.783 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 84.0 mm-40 -102.46 -23.8 13.89 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 125.941 1.696 . . . . 0.0 112.179 173.201 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 89.9 m-70 -138.13 160.07 40.38 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 126.254 1.822 . . . . 0.0 111.01 -179.05 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -83.1 128.22 34.29 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 125.28 1.432 . . . . 0.0 113.966 -178.912 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 84.9 t80 -130.69 122.65 27.71 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 115.107 1.521 . . . . 0.0 115.107 -176.973 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -95.68 134.77 38.2 Favored 'General case' 0 N--CA 1.48 1.069 0 N-CA-C 115.652 1.723 . . . . 0.0 115.652 174.114 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -74.59 120.51 20.24 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-O 122.12 0.962 . . . . 0.0 112.947 -175.817 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 4.4 t -90.79 6.98 42.05 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 126.836 2.054 . . . . 0.0 115.84 179.894 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -153.23 155.13 36.04 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 129.172 2.989 . . . . 0.0 111.685 -178.61 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 536' ' ' THR . . . . . . . . . . . . 0.264 0.9 OUTLIER -65.38 -25.56 67.62 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 116.124 1.898 . . . . 0.0 116.124 177.16 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 90.2 m-20 -92.74 -8.58 43.39 Favored 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 115.47 1.656 . . . . 0.0 115.47 175.594 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -74.47 146.46 42.77 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.767 1.227 . . . . 0.0 110.909 174.447 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -84.9 159.4 20.34 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 126.398 1.879 . . . . 0.0 110.202 174.637 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 17.8 tt0 -118.84 138.6 52.61 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.454 1.502 . . . . 0.0 110.658 173.844 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 91.3 mt -133.2 141.23 47.98 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 125.082 1.353 . . . . 0.0 111.953 -174.79 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.23 143.28 40.61 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 125.063 1.345 . . . . 0.0 108.507 164.812 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -53.83 117.8 3.46 Favored 'General case' 0 CA--C 1.548 0.894 0 O-C-N 121.633 -0.667 . . . . 0.0 111.94 -179.868 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 110.85 -9.71 29.77 Favored Glycine 0 CA--C 1.532 1.109 0 C-N-CA 126.772 2.13 . . . . 0.0 113.939 -175.347 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 69.0 m-20 -74.83 121.44 21.82 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 118.689 1.245 . . . . 0.0 113.377 -173.881 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 2.7 t -72.31 136.1 26.37 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 O-C-N 121.713 -0.617 . . . . 0.0 112.071 172.393 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -124.08 122.27 63.99 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.6 0 C-N-CA 126.16 1.784 . . . . 0.0 111.428 175.93 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 548' ' ' LEU . . . . . 0.51 ' CD2' ' HE2' ' A' ' 524' ' ' LYS . 20.0 mt -78.37 99.42 6.36 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.637 1.175 . . . . 0.0 108.637 174.983 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 549' ' ' VAL . . . . . . . . . . . . . 6.1 t -60.92 133.12 26.7 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.268 0 N-CA-C 114.583 1.327 . . . . 0.0 114.583 172.984 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 16.8 pt -130.42 156.17 79.95 Favored Pre-proline 0 CA--C 1.55 0.958 0 C-N-CA 126.77 2.028 . . . . 0.0 110.428 177.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 92.3 Cg_endo -72.19 165.55 32.3 Favored 'Trans proline' 0 CA--C 1.536 0.596 0 C-N-CA 124.194 3.263 . . . . 0.0 111.638 173.024 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 66.0 m-85 . . . . . 0 CA--C 1.535 0.389 0 N-CA-C 116.28 1.956 . . . . 0.0 116.28 -177.692 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 4.5 tp60 . . . . . 0 CA--C 1.54 0.579 0 CA-C-O 121.898 0.856 . . . . 0.0 112.072 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -113.33 141.9 46.49 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 128.146 2.578 . . . . 0.0 113.607 171.169 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 82.5 tt0 -64.42 120.34 12.08 Favored 'General case' 0 N--CA 1.478 0.948 0 O-C-N 119.654 -1.904 . . . . 0.0 112.032 -171.168 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 85.13 5.71 85.42 Favored Glycine 0 CA--C 1.539 1.576 0 C-N-CA 124.897 1.237 . . . . 0.0 115.826 -175.42 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 41.1 m95 -94.33 173.21 7.75 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 125.386 1.474 . . . . 0.0 113.86 178.396 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 17.3 mt -139.92 154.34 47.21 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 125.137 1.375 . . . . 0.0 110.618 166.704 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 31.4 tpp -107.34 143.33 35.78 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 125.28 1.432 . . . . 0.0 110.932 168.731 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -169.41 -172.42 36.04 Favored Glycine 0 CA--C 1.526 0.742 0 C-N-CA 124.38 0.991 . . . . 0.0 112.607 174.376 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 12.0 p -134.22 140.41 46.13 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.568 0 C-N-CA 125.569 1.548 . . . . 0.0 109.124 173.586 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 35.9 mtmt -56.39 136.16 53.79 Favored 'General case' 0 N--CA 1.468 0.428 0 O-C-N 121.24 -0.913 . . . . 0.0 111.356 176.347 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 52.3 tt0 -61.57 -42.41 98.8 Favored 'General case' 0 C--O 1.22 -0.449 0 CA-C-O 117.868 -1.063 . . . . 0.0 110.71 176.355 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 40.1 t -58.58 -37.2 75.26 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 119.696 1.135 . . . . 0.0 112.501 174.634 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 73.6 m-20 -63.75 -44.27 94.0 Favored 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 114.771 1.397 . . . . 0.0 114.771 172.516 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 55.3 t-105 -75.35 -29.36 59.91 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 124.941 1.296 . . . . 0.0 113.634 177.953 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 5.6 t-20 -68.44 -33.51 74.34 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 126.638 1.975 . . . . 0.0 110.711 172.873 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 30.5 mm100 -79.06 -3.7 46.54 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 124.636 1.174 . . . . 0.0 113.92 167.945 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 574' ' ' HIS . . . . . . . . . . . . 0.283 86.4 m-70 64.13 31.93 13.0 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 127.605 2.362 . . . . 0.0 115.547 168.65 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 78.2 mttt -66.6 170.87 5.69 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 127.566 2.346 . . . . 0.0 114.108 -178.225 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 21.4 pt-20 -59.95 104.65 0.32 Allowed 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 124.629 1.172 . . . . 0.0 113.031 171.738 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 57.7 tp -55.74 -42.84 75.98 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 124.226 1.01 . . . . 0.0 112.421 -171.204 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 2.8 pt-20 -61.86 -30.48 70.88 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 114.73 1.381 . . . . 0.0 114.73 -176.131 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 28.2 mmmt -97.47 -30.68 12.76 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 123.547 0.739 . . . . 0.0 112.819 -179.677 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 32.8 m -70.27 -40.39 74.36 Favored 'General case' 0 CA--C 1.538 0.492 0 N-CA-C 113.507 0.928 . . . . 0.0 113.507 173.141 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 29.6 ptt85 -64.39 161.81 16.26 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 123.867 0.867 . . . . 0.0 112.781 178.374 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -175.44 173.39 46.21 Favored Glycine 0 CA--C 1.52 0.354 0 CA-C-N 115.4 -0.818 . . . . 0.0 114.032 174.15 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 30.1 m -87.87 143.7 10.74 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.274 0 C-N-CA 123.262 0.625 . . . . 0.0 110.199 171.76 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 45.4 p90 -143.55 156.58 60.02 Favored Pre-proline 0 CA--C 1.541 0.629 0 C-N-CA 124.742 1.217 . . . . 0.0 112.346 176.7 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -69.75 111.21 2.75 Favored 'Trans proline' 0 C--N 1.347 0.49 0 C-N-CA 122.291 1.994 . . . . 0.0 109.903 172.762 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 19.6 pt-20 -55.82 -29.71 60.23 Favored 'General case' 0 N--CA 1.475 0.806 0 O-C-N 121.547 -0.721 . . . . 0.0 112.076 -179.07 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 10.9 p-10 -66.32 -20.97 66.24 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 125.604 1.561 . . . . 0.0 114.001 178.612 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 14.0 m-85 -69.07 -14.46 63.03 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 116.717 2.117 . . . . 0.0 116.717 164.605 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 589' ' ' THR . . . . . . . . . . . . . 63.5 p -122.0 173.43 7.54 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 126.277 1.831 . . . . 0.0 111.097 -176.357 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 15.1 pt-20 -126.55 136.34 52.44 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 124.245 1.018 . . . . 0.0 109.001 173.474 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.41 128.22 35.6 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 124.247 1.019 . . . . 0.0 108.692 178.606 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 592' ' ' VAL . . . . . . . . . . . . . 1.9 m . . . . . 0 CA--C 1.548 0.886 0 C-N-CA 125.624 1.57 . . . . 0.0 107.666 178.019 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 68.5 Cg_endo . . . . . 0 CA--C 1.543 0.974 0 N-CA-C 113.633 0.589 . . . . 0.0 113.633 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 16.0 t -128.74 126.14 64.51 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.126 0 C-N-CA 125.194 1.398 . . . . 0.0 112.495 -177.081 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -65.79 129.12 94.25 Favored Pre-proline 0 CA--C 1.55 0.969 0 O-C-N 121.533 -0.729 . . . . 0.0 111.475 -178.542 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 26.6 Cg_endo -69.42 157.16 62.07 Favored 'Trans proline' 0 CA--C 1.544 0.985 0 C-N-CA 122.165 1.91 . . . . 0.0 112.718 -173.847 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo . . . . . 0 CA--C 1.538 0.682 0 C-N-CA 123.054 2.503 . . . . 0.0 111.944 -174.809 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 14.0 mt . . . . . 0 CA--C 1.543 0.687 0 N-CA-C 113.419 0.896 . . . . 0.0 113.419 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_endo -66.2 159.53 49.29 Favored 'Trans proline' 0 CA--C 1.538 0.708 0 C-N-CA 123.923 3.082 . . . . 0.0 114.241 -174.039 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 96.1 Cg_endo -68.36 130.15 20.56 Favored 'Trans proline' 0 N--CA 1.457 -0.622 0 C-N-CA 123.366 2.71 . . . . 0.0 109.628 -179.742 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 78.84 1.23 83.9 Favored Glycine 0 CA--C 1.537 1.454 0 CA-C-O 116.777 -2.124 . . . . 0.0 115.578 -175.441 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 22.2 t80 -36.42 133.13 0.54 Allowed 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 117.63 2.456 . . . . 0.0 117.63 -179.751 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 31.0 mtm -100.58 -57.78 2.04 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 123.065 0.546 . . . . 0.0 111.949 -177.005 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 523' ' ' PHE . . . . . . . . . . . . . 20.3 p90 -166.68 175.09 8.15 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 126.911 2.084 . . . . 0.0 112.46 -173.233 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 66.6 mttt -107.35 162.69 13.68 Favored 'General case' 0 N--CA 1.476 0.867 0 O-C-N 120.169 -1.582 . . . . 0.0 112.178 168.629 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 5.1 m -133.33 162.5 39.68 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 C-N-CA 126.905 2.082 . . . . 0.0 109.768 164.057 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 42.5 tt0 -128.71 130.45 47.15 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-N 118.868 0.758 . . . . 0.0 111.924 169.305 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 527' ' ' ALA . . . . . . . . . . . . . . . -60.92 127.36 31.18 Favored 'General case' 0 N--CA 1.466 0.353 0 O-C-N 121.124 -0.985 . . . . 0.0 111.548 -179.677 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 61.6 mm-40 -89.94 -25.45 20.92 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 125.308 1.443 . . . . 0.0 111.973 171.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 96.5 m-70 -142.44 163.77 31.94 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 126.974 2.109 . . . . 0.0 110.257 -172.944 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 35.8 m-20 -80.03 137.4 36.8 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 123.845 0.858 . . . . 0.0 111.726 177.474 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 89.2 t80 -134.36 121.3 20.99 Favored 'General case' 0 C--O 1.236 0.358 0 N-CA-C 114.065 1.135 . . . . 0.0 114.065 175.18 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -88.22 117.11 26.9 Favored 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 115.289 1.589 . . . . 0.0 115.289 173.701 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -67.77 123.68 21.2 Favored 'General case' 0 CA--C 1.537 0.468 0 O-C-N 121.898 -0.501 . . . . 0.0 110.902 171.336 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 6.2 t -115.9 -2.04 12.43 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 126.575 1.95 . . . . 0.0 114.242 -177.281 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 39.5 m-20 -113.73 156.56 23.58 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 125.713 1.605 . . . . 0.0 115.108 157.135 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 6.7 t -59.26 -29.09 67.31 Favored 'General case' 0 CA--C 1.545 0.785 0 N-CA-C 114.33 1.234 . . . . 0.0 114.33 170.584 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -70.42 -20.17 62.94 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 116.862 2.171 . . . . 0.0 116.862 169.467 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 82.1 mt-10 -85.05 149.93 25.22 Favored 'General case' 0 CA--C 1.542 0.651 0 O-C-N 120.671 -1.268 . . . . 0.0 113.95 -170.453 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -99.89 127.83 46.03 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 126.531 1.932 . . . . 0.0 110.663 179.134 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 14.1 tt0 -88.11 127.85 35.42 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 123.47 0.708 . . . . 0.0 111.473 -179.517 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 71.1 mt -119.34 140.7 49.91 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 124.58 1.152 . . . . 0.0 111.932 -177.426 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 14.4 tppt? -107.26 138.28 43.75 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 125.883 1.673 . . . . 0.0 109.063 164.649 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -49.57 114.32 1.02 Allowed 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.771 0.829 . . . . 0.0 110.872 175.173 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 107.52 -4.89 34.99 Favored Glycine 0 CA--C 1.534 1.238 0 C-N-CA 126.693 2.092 . . . . 0.0 114.677 -175.607 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 77.0 m-20 -70.0 120.46 15.75 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 119.734 1.767 . . . . 0.0 114.958 176.546 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 27.4 t -70.92 135.23 28.5 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 CA-C-N 118.539 0.609 . . . . 0.0 110.128 166.569 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 1.4 t -126.07 121.59 59.74 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.404 0 C-N-CA 125.547 1.539 . . . . 0.0 110.474 175.375 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 30.6 mt -78.93 104.81 9.81 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 107.937 -1.135 . . . . 0.0 107.937 175.627 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 549' ' ' VAL . . . . . . . . . . . . . 30.9 t -61.03 131.71 26.14 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.901 0 CA-C-O 121.942 0.877 . . . . 0.0 113.17 170.743 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 5.6 pt -126.11 157.11 70.79 Favored Pre-proline 0 CA--C 1.542 0.672 0 C-N-CA 126.582 1.953 . . . . 0.0 108.504 175.936 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -66.62 145.89 77.51 Favored 'Trans proline' 0 N--CA 1.458 -0.595 0 C-N-CA 122.905 2.403 . . . . 0.0 110.74 176.147 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 32.8 m-85 . . . . . 0 C--O 1.234 0.28 0 N-CA-C 115.09 1.515 . . . . 0.0 115.09 177.912 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 35.6 tt0 . . . . . 0 CA--C 1.543 0.691 0 N-CA-C 113.37 0.878 . . . . 0.0 113.37 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 66.5 m-20 -95.13 146.6 24.19 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 127.945 2.498 . . . . 0.0 113.277 176.999 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -81.55 133.9 35.44 Favored 'General case' 0 N--CA 1.472 0.664 0 O-C-N 120.364 -1.46 . . . . 0.0 113.349 -173.843 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 76.9 -1.02 64.22 Favored Glycine 0 CA--C 1.538 1.522 0 C-N-CA 124.025 0.822 . . . . 0.0 114.282 -169.841 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 57.9 m95 -97.07 158.71 15.3 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 125.859 1.663 . . . . 0.0 112.056 174.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -135.03 156.47 48.98 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 126.993 2.117 . . . . 0.0 109.486 176.884 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 51.5 ttm -119.01 141.28 48.82 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 124.285 1.034 . . . . 0.0 112.004 175.646 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -171.06 -172.08 36.93 Favored Glycine 0 CA--C 1.524 0.625 0 C-N-CA 123.817 0.722 . . . . 0.0 113.267 179.773 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 12.7 p -133.47 139.94 47.89 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 C-N-CA 126.23 1.812 . . . . 0.0 109.189 173.087 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 34.9 mtmt -57.24 136.61 56.49 Favored 'General case' 0 N--CA 1.469 0.479 0 O-C-N 121.086 -1.009 . . . . 0.0 111.308 175.865 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -60.59 -39.43 88.08 Favored 'General case' 0 CA--C 1.539 0.552 0 O-C-N 122.012 -0.43 . . . . 0.0 110.714 174.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 34.2 t -71.13 -14.16 62.19 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 113.911 1.078 . . . . 0.0 113.911 176.073 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 72.5 m-20 -83.68 -45.22 13.66 Favored 'General case' 0 CA--C 1.541 0.626 0 O-C-N 120.709 -1.244 . . . . 0.0 113.848 166.465 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 61.4 t-105 -71.39 -37.76 71.55 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.952 1.301 . . . . 0.0 114.293 179.377 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 7.0 t-20 -67.17 -13.8 62.3 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 124.808 1.243 . . . . 0.0 112.027 174.858 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 5.2 mm-40 -91.48 1.58 57.03 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 125.333 1.453 . . . . 0.0 114.395 171.217 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 48.1 m-70 60.11 35.25 21.24 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 125.275 1.43 . . . . 0.0 112.935 177.84 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 26.6 mtpp -91.58 163.19 14.22 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 125.943 1.697 . . . . 0.0 111.983 -175.829 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 10.7 pm0 -56.37 99.6 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 125.37 1.468 . . . . 0.0 114.618 -170.243 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 54.8 tp -56.22 -46.04 79.66 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 124.186 0.994 . . . . 0.0 111.718 -173.631 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 -62.73 -14.44 44.51 Favored 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 115.095 1.517 . . . . 0.0 115.095 -178.847 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 33.8 mmtp -112.48 -35.88 5.42 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.752 1.221 . . . . 0.0 113.321 175.205 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 83.0 m -67.04 -24.12 65.96 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.163 0.985 . . . . 0.0 112.297 175.517 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 17.3 ptt180 -68.49 149.75 48.89 Favored 'General case' 0 N--CA 1.47 0.526 0 N-CA-C 113.348 0.869 . . . . 0.0 113.348 175.057 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -164.44 172.59 40.25 Favored Glycine 0 CA--C 1.528 0.875 0 CA-C-N 114.598 -1.183 . . . . 0.0 113.917 174.255 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 28.4 m -92.31 143.48 11.28 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 C-N-CA 124.906 1.282 . . . . 0.0 112.108 170.339 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 45.8 p90 -138.6 154.56 73.37 Favored Pre-proline 0 CA--C 1.546 0.789 0 C-N-CA 124.786 1.234 . . . . 0.0 113.949 176.282 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -65.78 113.85 2.71 Favored 'Trans proline' 0 C--N 1.35 0.618 0 C-N-CA 122.924 2.416 . . . . 0.0 110.291 169.672 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 20.1 pt-20 -60.08 -26.0 65.84 Favored 'General case' 0 N--CA 1.479 1.002 0 O-C-N 121.493 -0.754 . . . . 0.0 112.203 -175.136 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 11.2 p-10 -71.92 -18.49 62.02 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 126.969 2.108 . . . . 0.0 113.799 -179.576 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 19.7 m-85 -72.23 -12.19 61.06 Favored 'General case' 0 N--CA 1.467 0.395 0 N-CA-C 116.276 1.954 . . . . 0.0 116.276 166.496 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 589' ' ' THR . . . . . . . . . . . . . 69.5 p -128.25 168.39 15.55 Favored 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 125.536 1.534 . . . . 0.0 110.658 -174.354 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 16.3 pt-20 -122.35 137.15 54.95 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 124.124 0.97 . . . . 0.0 109.976 174.798 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 15.3 tpp85 -64.32 131.58 47.69 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 124.706 1.202 . . . . 0.0 109.94 177.619 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 592' ' ' VAL . . . . . . . . . . . . . 2.9 m . . . . . 0 N--CA 1.482 1.13 0 C-N-CA 125.645 1.578 . . . . 0.0 110.232 -177.545 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 98.9 Cg_endo . . . . . 0 CA--C 1.541 0.826 0 CA-C-O 121.67 0.613 . . . . 0.0 113.19 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 6.5 t -128.45 140.37 49.4 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.875 0 C-N-CA 126.153 1.781 . . . . 0.0 111.968 172.141 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -67.16 139.19 95.0 Favored Pre-proline 0 CA--C 1.55 0.965 0 O-C-N 121.518 -0.739 . . . . 0.0 112.835 -178.112 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -75.82 162.99 34.27 Favored 'Trans proline' 0 CA--C 1.543 0.967 0 C-N-CA 122.866 2.377 . . . . 0.0 113.204 -178.823 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 64.5 Cg_endo . . . . . 0 CA--C 1.539 0.772 0 C-N-CA 123.602 2.868 . . . . 0.0 112.408 179.661 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 10.8 mt . . . . . 0 CA--C 1.542 0.642 0 N-CA-C 111.69 0.256 . . . . 0.0 111.69 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -68.25 159.09 54.74 Favored 'Trans proline' 0 CA--C 1.54 0.795 0 C-N-CA 123.302 2.668 . . . . 0.0 114.025 -172.737 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -61.61 129.96 29.84 Favored 'Trans proline' 0 N--CA 1.458 -0.607 0 C-N-CA 123.609 2.873 . . . . 0.0 110.998 178.856 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 75.79 1.11 66.0 Favored Glycine 0 CA--C 1.536 1.405 0 CA-C-O 117.294 -1.836 . . . . 0.0 115.893 -177.203 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 30.4 t80 -37.18 128.87 0.95 Allowed 'General case' 0 C--N 1.349 0.578 0 N-CA-C 117.155 2.28 . . . . 0.0 117.155 -179.405 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 56.1 mtm -100.01 -53.87 3.04 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 123.943 0.897 . . . . 0.0 113.025 -177.876 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 523' ' ' PHE . . . . . . . . . . . . . 29.1 p90 -165.93 170.67 13.46 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 126.497 1.919 . . . . 0.0 112.974 -174.159 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 524' ' ' LYS . . . . . 0.517 ' HE2' ' CD2' ' A' ' 548' ' ' LEU . 80.0 mttt -101.86 161.98 13.26 Favored 'General case' 0 N--CA 1.467 0.394 0 O-C-N 121.131 -0.981 . . . . 0.0 112.148 168.189 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 15.3 m -132.84 162.82 39.33 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 C-N-CA 126.471 1.909 . . . . 0.0 109.691 164.987 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 55.5 tt0 -127.12 130.62 50.18 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 118.827 0.739 . . . . 0.0 111.548 170.04 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 527' ' ' ALA . . . . . . . . . . . . . . . -59.53 130.9 49.15 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 123.693 0.797 . . . . 0.0 111.359 176.246 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 31.7 mm-40 -93.9 -25.79 17.16 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.372 1.469 . . . . 0.0 110.604 168.585 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 62.7 m-70 -132.55 164.86 25.69 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 127.03 2.132 . . . . 0.0 111.903 -176.691 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -85.07 132.27 34.34 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 106.504 -1.665 . . . . 0.0 106.504 175.891 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 90.0 t80 -120.62 109.99 15.9 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 124.071 0.948 . . . . 0.0 113.134 172.093 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 1.2 m -84.93 108.16 17.43 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 115.178 1.547 . . . . 0.0 115.178 173.638 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -64.25 144.38 57.19 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 125.951 1.7 . . . . 0.0 112.707 178.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 2.2 t -125.43 11.35 8.02 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 126.864 2.066 . . . . 0.0 115.44 -177.067 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 28.4 t0 -143.69 157.54 44.33 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 125.808 1.643 . . . . 0.0 107.619 177.595 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 3.2 t -69.93 -21.33 63.29 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 114.681 1.363 . . . . 0.0 114.681 165.036 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 22.9 m-20 -73.46 -19.96 60.82 Favored 'General case' 0 CA--C 1.541 0.635 0 N-CA-C 115.105 1.52 . . . . 0.0 115.105 169.497 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 73.5 mt-10 -87.13 142.34 27.99 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 125.774 1.63 . . . . 0.0 114.553 -177.425 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -88.41 131.76 34.73 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 126.717 2.007 . . . . 0.0 110.035 174.763 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -85.28 133.9 34.14 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 123.614 0.765 . . . . 0.0 110.797 172.344 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 77.0 mt -124.86 147.92 48.53 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.586 1.154 . . . . 0.0 111.957 175.574 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 7.8 tmtt? -115.47 142.98 45.99 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 126.179 1.792 . . . . 0.0 108.147 164.899 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -48.0 123.75 6.63 Favored 'General case' 0 CA--C 1.544 0.735 0 CA-C-N 119.167 0.894 . . . . 0.0 111.068 177.083 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 95.26 0.65 63.11 Favored Glycine 0 CA--C 1.534 1.245 0 C-N-CA 125.477 1.513 . . . . 0.0 114.526 -177.45 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 81.9 m-20 -72.59 119.25 16.55 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 119.249 1.525 . . . . 0.0 113.645 176.107 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 3.4 t -71.89 137.13 24.26 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.573 0 O-C-N 122.126 -0.359 . . . . 0.0 111.321 169.585 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 1.4 t -129.1 124.5 60.78 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.544 0 C-N-CA 125.625 1.57 . . . . 0.0 111.57 177.753 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 548' ' ' LEU . . . . . 0.517 ' CD2' ' HE2' ' A' ' 524' ' ' LYS . 16.7 mt -82.48 99.8 9.69 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.883 1.273 . . . . 0.0 108.581 176.756 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 549' ' ' VAL . . . . . . . . . . . . . 5.1 t -63.41 132.79 29.35 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.198 0 N-CA-C 114.692 1.367 . . . . 0.0 114.692 175.333 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 11.3 pt -129.22 156.55 78.15 Favored Pre-proline 0 CA--C 1.548 0.901 0 C-N-CA 127.09 2.156 . . . . 0.0 110.002 177.765 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -75.39 148.91 34.42 Favored 'Trans proline' 0 CA--C 1.534 0.513 0 C-N-CA 123.918 3.078 . . . . 0.0 112.058 175.678 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 552' ' ' PHE . . . . . 0.458 ' CE1' ' HA ' ' A' ' 558' ' ' GLN . 14.9 m-85 . . . . . 0 CA--C 1.538 0.5 0 N-CA-C 114.368 1.248 . . . . 0.0 114.368 179.163 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 558' ' ' GLN . . . . . 0.458 ' HA ' ' CE1' ' A' ' 552' ' ' PHE . 29.9 tt0 . . . . . 0 CA--C 1.534 0.343 0 CA-C-O 121.939 0.875 . . . . 0.0 112.276 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -142.31 144.41 33.23 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 125.83 1.652 . . . . 0.0 114.746 -179.702 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 39.0 tp10 -68.39 129.53 40.19 Favored 'General case' 0 CA--C 1.537 0.449 0 O-C-N 121.382 -0.824 . . . . 0.0 111.934 -176.526 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 83.31 -6.77 70.63 Favored Glycine 0 CA--C 1.537 1.428 0 C-N-CA 124.76 1.172 . . . . 0.0 114.436 -175.06 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 61.9 m95 -93.09 160.81 14.69 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 125.08 1.352 . . . . 0.0 112.688 174.63 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 14.0 mt -138.08 153.44 49.3 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 126.047 1.739 . . . . 0.0 109.332 168.712 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 54.4 ttm -109.69 143.51 39.37 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 124.184 0.993 . . . . 0.0 111.277 173.54 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -172.45 -171.84 37.68 Favored Glycine 0 CA--C 1.522 0.479 0 C-N-CA 123.699 0.666 . . . . 0.0 112.758 176.907 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 12.0 p -131.77 138.68 52.26 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.503 0 C-N-CA 125.03 1.332 . . . . 0.0 108.65 171.434 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 35.5 mtmt -59.18 136.71 58.04 Favored 'General case' 0 N--CA 1.467 0.404 0 O-C-N 121.272 -0.892 . . . . 0.0 110.759 178.119 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -59.19 -41.86 89.51 Favored 'General case' 0 C--O 1.219 -0.542 0 CA-C-O 117.906 -1.045 . . . . 0.0 110.37 175.654 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 38.0 t -62.39 -33.66 75.2 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 120.247 1.385 . . . . 0.0 112.467 176.781 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 77.8 m-20 -69.16 -43.9 73.37 Favored 'General case' 0 CA--C 1.542 0.666 0 N-CA-C 115.488 1.662 . . . . 0.0 115.488 173.402 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 65.7 t-105 -72.01 -31.62 66.39 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.606 1.562 . . . . 0.0 113.203 175.671 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 46.7 t-20 -76.32 -24.12 54.29 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 127.603 2.361 . . . . 0.0 111.893 172.085 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 81.2 mt-30 -80.8 -3.82 52.42 Favored 'General case' 0 CA--C 1.544 0.733 0 O-C-N 120.961 -1.087 . . . . 0.0 113.213 163.29 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 88.2 m-70 61.12 32.64 19.62 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 125.998 1.719 . . . . 0.0 113.755 171.769 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 74.3 mttt -70.03 160.48 31.89 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.711 1.604 . . . . 0.0 111.696 175.432 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 9.2 pm0 -56.29 111.59 1.01 Allowed 'General case' 0 CA--C 1.549 0.937 0 N-CA-C 113.383 0.882 . . . . 0.0 113.383 176.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 45.5 tp -57.54 -49.48 76.21 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 124.254 1.022 . . . . 0.0 112.872 -169.8 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 65.8 mm-40 -66.19 -16.51 64.05 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 113.828 1.047 . . . . 0.0 113.828 -174.378 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 18.3 tptm -97.34 -44.78 6.74 Favored 'General case' 0 N--CA 1.465 0.322 0 C-N-CA 125.249 1.42 . . . . 0.0 112.05 174.148 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 56.5 m -76.67 -17.09 59.33 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 114.927 1.454 . . . . 0.0 114.927 -177.153 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 7.9 ptt85 -63.33 160.12 16.61 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 123.807 0.843 . . . . 0.0 112.544 169.05 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -169.14 174.5 43.61 Favored Glycine 0 CA--C 1.526 0.775 0 CA-C-N 115.564 -0.744 . . . . 0.0 113.641 170.418 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 31.3 m -91.01 139.88 16.92 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.382 0 C-N-CA 124.706 1.203 . . . . 0.0 111.164 168.274 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 41.8 p90 -135.64 154.7 78.33 Favored Pre-proline 0 CA--C 1.539 0.55 0 C-N-CA 124.831 1.253 . . . . 0.0 112.152 174.808 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -68.38 114.44 3.46 Favored 'Trans proline' 0 CA--C 1.535 0.558 0 C-N-CA 122.103 1.869 . . . . 0.0 110.103 170.66 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 15.4 pt-20 -54.02 -30.63 48.35 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.835 0.854 . . . . 0.0 112.617 -179.22 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 7.3 p-10 -70.03 -18.08 63.28 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 127.041 2.137 . . . . 0.0 113.481 -177.432 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 19.6 m-85 -72.4 -11.08 60.53 Favored 'General case' 0 CA--C 1.536 0.409 0 N-CA-C 116.442 2.016 . . . . 0.0 116.442 163.507 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 589' ' ' THR . . . . . . . . . . . . . 34.2 p -125.29 178.42 5.6 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 126.331 1.852 . . . . 0.0 112.675 -175.902 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -131.43 140.1 49.54 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 125.458 1.503 . . . . 0.0 110.089 169.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -64.11 114.19 4.01 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 124.767 1.227 . . . . 0.0 109.855 171.68 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 592' ' ' VAL . . . . . . . . . . . . . 1.3 m . . . . . 0 N--CA 1.478 0.952 0 C-N-CA 125.308 1.443 . . . . 0.0 108.977 176.99 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo . . . . . 0 CA--C 1.54 0.799 0 CA-C-O 121.552 0.563 . . . . 0.0 112.95 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 3.5 t -134.62 131.71 54.09 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 C-N-CA 125.276 1.431 . . . . 0.0 112.443 -178.087 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -68.52 133.43 90.91 Favored Pre-proline 0 CA--C 1.548 0.897 0 O-C-N 121.443 -0.786 . . . . 0.0 111.491 -176.321 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -78.58 165.13 25.37 Favored 'Trans proline' 0 CA--C 1.548 1.186 0 C-N-CA 122.982 2.455 . . . . 0.0 113.088 -178.334 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo . . . . . 0 CA--C 1.539 0.735 0 C-N-CA 123.533 2.822 . . . . 0.0 114.028 179.263 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 13.4 mt . . . . . 0 CA--C 1.538 0.517 0 CA-C-O 120.545 0.212 . . . . 0.0 110.526 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_endo -65.01 160.95 39.04 Favored 'Trans proline' 0 CA--C 1.538 0.695 0 C-N-CA 122.846 2.364 . . . . 0.0 113.484 -173.253 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -58.17 135.4 68.09 Favored 'Trans proline' 0 N--CA 1.46 -0.5 0 C-N-CA 122.893 2.396 . . . . 0.0 110.541 176.911 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 69.9 0.77 28.58 Favored Glycine 0 CA--C 1.535 1.308 0 CA-C-O 117.357 -1.802 . . . . 0.0 115.893 -178.677 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 34.7 t80 -36.29 125.28 0.79 Allowed 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 121.057 2.428 . . . . 0.0 116.814 -178.538 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 63.0 mtm -98.92 -53.31 3.31 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 123.344 0.658 . . . . 0.0 112.344 -177.15 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 523' ' ' PHE . . . . . . . . . . . . . 26.8 p90 -164.39 169.14 17.75 Favored 'General case' 0 C--O 1.223 -0.318 0 C-N-CA 126.332 1.853 . . . . 0.0 112.834 -174.093 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 524' ' ' LYS . . . . . 0.554 ' HE2' ' CD2' ' A' ' 548' ' ' LEU . 87.9 mttt -100.83 163.12 12.46 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 122.219 1.009 . . . . 0.0 111.253 166.938 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 17.3 m -135.45 161.6 38.9 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 C-N-CA 126.248 1.819 . . . . 0.0 109.016 165.92 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 58.0 tt0 -124.54 130.02 51.68 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 118.39 0.541 . . . . 0.0 111.877 169.848 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 527' ' ' ALA . . . . . . . . . . . . . . . -59.59 124.13 19.1 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.988 0.915 . . . . 0.0 111.95 177.341 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 75.6 mm-40 -87.94 -25.74 23.05 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.127 1.371 . . . . 0.0 112.298 173.769 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 59.0 m-70 -139.2 167.81 21.24 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 127.177 2.191 . . . . 0.0 109.221 178.522 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 10.6 p-10 -85.22 138.81 32.11 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 125.071 1.348 . . . . 0.0 114.512 174.609 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 89.7 t80 -133.12 107.55 8.28 Favored 'General case' 0 C--O 1.235 0.299 0 C-N-CA 125.09 1.356 . . . . 0.0 111.803 179.198 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 532' ' ' THR . . . . . . . . . . . . 0.251 0.6 OUTLIER -81.61 104.55 12.1 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 113.697 0.999 . . . . 0.0 113.697 170.884 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -59.7 133.05 55.74 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 125.337 1.455 . . . . 0.0 110.895 176.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 4.4 t -109.1 -10.48 15.0 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.618 1.567 . . . . 0.0 115.047 -171.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 12.3 m-20 -133.45 153.36 51.68 Favored 'General case' 0 N--CA 1.463 0.209 0 C-N-CA 126.38 1.872 . . . . 0.0 115.745 176.929 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 536' ' ' THR . . . . . . . . . . . . 0.252 1.3 t -62.43 -27.42 69.1 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 116.582 2.067 . . . . 0.0 116.582 -171.301 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 87.2 m-20 -72.54 -17.49 61.72 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 116.407 2.002 . . . . 0.0 116.407 171.13 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 82.6 mt-10 -82.27 149.78 27.63 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.383 1.473 . . . . 0.0 114.243 -177.343 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -97.89 128.71 44.66 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 126.638 1.975 . . . . 0.0 110.422 177.651 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 15.3 tt0 -86.15 127.81 34.78 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 123.613 0.765 . . . . 0.0 111.549 178.495 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 76.9 mt -122.43 143.97 49.34 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 124.7 1.2 . . . . 0.0 112.295 -178.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 6.6 tmtm? -115.78 147.42 40.99 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 126.23 1.812 . . . . 0.0 109.329 169.717 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -54.12 120.49 6.52 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-O 121.993 0.901 . . . . 0.0 110.888 -179.613 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 100.47 0.79 55.56 Favored Glycine 0 CA--C 1.529 0.917 0 C-N-CA 125.381 1.467 . . . . 0.0 114.756 -178.481 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 80.8 m-20 -70.86 122.59 20.21 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 119.303 1.552 . . . . 0.0 113.77 -179.516 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 58.7 t -69.9 133.99 30.9 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.614 0 N-CA-C 109.198 -0.668 . . . . 0.0 109.198 166.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -126.69 124.16 64.47 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.503 0 C-N-CA 124.794 1.238 . . . . 0.0 111.41 171.757 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 548' ' ' LEU . . . . . 0.554 ' CD2' ' HE2' ' A' ' 524' ' ' LYS . 20.0 mt -80.13 100.07 8.06 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.547 1.139 . . . . 0.0 108.477 175.621 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 549' ' ' VAL . . . . . . . . . . . . . 4.1 t -63.51 132.0 29.23 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.224 0 N-CA-C 114.688 1.366 . . . . 0.0 114.688 173.837 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 17.0 pt -128.12 155.65 77.68 Favored Pre-proline 0 CA--C 1.544 0.739 0 C-N-CA 126.54 1.936 . . . . 0.0 110.435 179.186 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -70.52 152.77 65.6 Favored 'Trans proline' 0 N--CA 1.459 -0.53 0 C-N-CA 123.548 2.832 . . . . 0.0 110.619 171.329 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 52.2 m-85 . . . . . 0 C--N 1.329 -0.321 0 N-CA-C 115.792 1.775 . . . . 0.0 115.792 -176.706 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 40.1 tt0 . . . . . 0 N--CA 1.468 0.472 0 N-CA-C 113.669 0.989 . . . . 0.0 113.669 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 25.7 m-20 -127.43 149.65 49.99 Favored 'General case' 0 CA--C 1.553 1.079 0 C-N-CA 125.411 1.485 . . . . 0.0 110.8 -178.141 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -70.77 120.25 16.09 Favored 'General case' 0 N--CA 1.477 0.905 0 O-C-N 120.637 -1.289 . . . . 0.0 112.813 -170.331 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 83.68 -0.11 89.67 Favored Glycine 0 CA--C 1.54 1.636 0 C-N-CA 124.422 1.01 . . . . 0.0 115.275 -173.754 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 53.8 m95 -90.34 164.71 14.23 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 125.285 1.434 . . . . 0.0 113.437 176.102 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 11.4 mt -134.06 161.23 35.43 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 125.256 1.422 . . . . 0.0 110.517 165.657 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 55.8 ttm -116.01 145.91 42.58 Favored 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 124.853 1.261 . . . . 0.0 112.018 171.59 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -172.56 -169.44 35.2 Favored Glycine 0 CA--C 1.525 0.673 0 C-N-CA 124.402 1.001 . . . . 0.0 112.434 178.073 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 14.7 p -136.6 141.57 40.62 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 C-N-CA 125.731 1.612 . . . . 0.0 109.461 173.636 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 37.1 mtmt -58.07 135.22 56.96 Favored 'General case' 0 N--CA 1.469 0.518 0 O-C-N 121.138 -0.976 . . . . 0.0 110.788 174.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 19.5 tt0 -60.76 -39.0 87.16 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 119.636 -0.826 . . . . 0.0 110.186 174.273 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 47.3 t -58.09 -37.36 74.36 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 124.293 1.037 . . . . 0.0 112.427 177.15 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 -74.19 -44.28 54.01 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 114.959 1.466 . . . . 0.0 114.959 175.861 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 60.3 t-105 -67.67 -32.29 72.86 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.589 1.156 . . . . 0.0 112.975 176.562 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 26.7 t-20 -66.48 -35.66 80.83 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 126.414 1.886 . . . . 0.0 112.278 174.221 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 75.5 mt-30 -75.9 -5.7 47.36 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 125.566 1.546 . . . . 0.0 113.649 175.241 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 95.8 m-70 56.43 48.16 17.44 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 125.136 1.374 . . . . 0.0 112.66 -178.123 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 26.9 mttp -75.76 162.25 28.35 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 124.961 1.305 . . . . 0.0 111.778 166.533 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 14.1 pm0 -63.88 103.14 0.54 Allowed 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.379 1.072 . . . . 0.0 112.747 177.761 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 32.4 tp -58.31 -35.56 72.05 Favored 'General case' 0 CA--C 1.537 0.449 0 O-C-N 121.212 -0.93 . . . . 0.0 111.903 -174.515 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -65.08 -16.06 63.05 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 124.59 1.156 . . . . 0.0 113.885 -179.17 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 32.1 mmtp -114.28 -39.98 3.76 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 125.585 1.554 . . . . 0.0 112.442 177.623 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 39.1 m -70.51 -24.83 62.9 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 114.221 1.193 . . . . 0.0 114.221 177.063 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 17.3 ptp180 -62.01 160.97 11.46 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-N 118.91 0.777 . . . . 0.0 111.777 169.104 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -173.49 172.44 45.2 Favored Glycine 0 CA--C 1.521 0.468 0 CA-C-N 115.401 -0.818 . . . . 0.0 114.078 175.823 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 31.9 m -89.35 139.19 17.83 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.387 0 C-N-CA 124.282 1.033 . . . . 0.0 111.374 169.738 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 40.7 p90 -133.6 154.8 80.88 Favored Pre-proline 0 CA--C 1.541 0.628 0 C-N-CA 124.62 1.168 . . . . 0.0 112.889 173.381 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -65.61 110.75 1.7 Allowed 'Trans proline' 0 C--N 1.346 0.436 0 C-N-CA 122.039 1.826 . . . . 0.0 109.275 168.658 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 17.5 pt-20 -57.51 -26.93 62.07 Favored 'General case' 0 N--CA 1.474 0.744 0 O-C-N 121.506 -0.746 . . . . 0.0 112.32 -176.799 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 13.3 p-10 -71.51 -12.45 61.38 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 127.063 2.145 . . . . 0.0 114.64 178.278 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 18.4 m-85 -74.31 -13.74 60.8 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 116.862 2.171 . . . . 0.0 116.862 163.731 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 589' ' ' THR . . . . . . . . . . . . . 58.7 p -122.63 173.21 7.86 Favored 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 125.671 1.588 . . . . 0.0 111.893 -174.222 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -127.72 136.41 51.5 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 123.916 0.887 . . . . 0.0 109.691 171.731 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -64.33 120.09 11.55 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 125.567 1.547 . . . . 0.0 109.221 178.579 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 592' ' ' VAL . . . . . . . . . . . . . 2.3 m . . . . . 0 N--CA 1.476 0.86 0 C-N-CA 124.944 1.298 . . . . 0.0 108.329 177.539 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 88.9 Cg_endo . . . . . 0 CA--C 1.539 0.771 0 CA-C-O 121.343 0.476 . . . . 0.0 112.612 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 4.0 p -140.26 147.35 23.49 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 C-N-CA 125.958 1.703 . . . . 0.0 109.301 170.948 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -72.34 141.55 83.42 Favored Pre-proline 0 CA--C 1.554 1.101 0 N-CA-C 113.401 0.889 . . . . 0.0 113.401 -173.641 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -79.12 168.54 20.34 Favored 'Trans proline' 0 CA--C 1.552 1.396 0 C-N-CA 123.451 2.767 . . . . 0.0 113.378 178.061 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 35.9 Cg_exo . . . . . 0 CA--C 1.539 0.729 0 C-N-CA 124.217 3.278 . . . . 0.0 114.19 -179.694 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 10.3 mt . . . . . 0 CA--C 1.55 0.973 0 CA-C-O 119.872 -0.109 . . . . 0.0 111.249 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -66.43 161.51 40.66 Favored 'Trans proline' 0 CA--C 1.538 0.709 0 C-N-CA 123.477 2.785 . . . . 0.0 114.287 -173.759 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -61.19 128.53 25.41 Favored 'Trans proline' 0 N--CA 1.459 -0.519 0 C-N-CA 123.244 2.63 . . . . 0.0 111.098 -179.4 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 73.03 6.84 69.22 Favored Glycine 0 CA--C 1.534 1.257 0 CA-C-O 117.453 -1.748 . . . . 0.0 116.238 -178.116 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 35.1 t80 -37.88 135.68 0.63 Allowed 'General case' 0 CA--C 1.547 0.865 0 CA-C-N 120.852 2.326 . . . . 0.0 117.134 -179.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 60.8 mtm -109.26 -51.5 2.87 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.448 0.699 . . . . 0.0 112.832 -179.099 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 523' ' ' PHE . . . . . . . . . . . . . 23.7 p90 -165.54 167.41 17.45 Favored 'General case' 0 C--O 1.223 -0.314 0 C-N-CA 125.984 1.713 . . . . 0.0 114.018 -174.018 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 524' ' ' LYS . . . . . 0.418 ' HE2' ' CD2' ' A' ' 548' ' ' LEU . 69.6 mttt -99.7 164.05 12.22 Favored 'General case' 0 N--CA 1.47 0.535 0 O-C-N 121.389 -0.819 . . . . 0.0 111.664 166.312 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 17.8 m -139.45 156.12 26.38 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.975 0 C-N-CA 126.952 2.101 . . . . 0.0 109.007 167.685 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 63.8 tt0 -119.01 128.88 54.79 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 119.157 0.889 . . . . 0.0 112.007 170.912 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 527' ' ' ALA . . . . . . . . . . . . . . . -60.26 117.82 5.65 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.708 1.203 . . . . 0.0 111.726 176.434 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 65.4 mm-40 -81.44 -26.36 35.4 Favored 'General case' 0 CA--C 1.537 0.442 0 C-N-CA 124.741 1.217 . . . . 0.0 111.076 170.58 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 81.3 m-70 -138.11 164.27 29.55 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 125.36 1.464 . . . . 0.0 112.476 -175.441 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . 0.253 1.7 p30 -77.41 132.33 38.45 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 115.015 1.487 . . . . 0.0 115.015 176.305 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 79.2 t80 -137.82 122.1 18.17 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 113.728 1.011 . . . . 0.0 113.728 176.707 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -87.44 125.14 34.11 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 114.665 1.357 . . . . 0.0 114.665 175.071 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -66.56 129.7 40.71 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-O 121.122 0.486 . . . . 0.0 110.851 169.561 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 4.6 p -97.9 -36.02 10.3 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 126.496 1.918 . . . . 0.0 113.777 171.436 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 96.4 m-20 -95.09 156.44 16.32 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 125.262 1.425 . . . . 0.0 114.642 176.197 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 7.7 t -54.99 -29.48 57.25 Favored 'General case' 0 N--CA 1.472 0.625 0 N-CA-C 114.665 1.357 . . . . 0.0 114.665 164.822 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 90.8 m-20 -104.97 6.13 33.26 Favored 'General case' 0 CA--C 1.544 0.726 0 N-CA-C 115.353 1.612 . . . . 0.0 115.353 175.867 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 57.3 mt-10 -86.19 152.11 23.09 Favored 'General case' 0 CA--C 1.541 0.621 0 O-C-N 120.392 -1.443 . . . . 0.0 111.103 165.0 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -101.87 132.92 47.37 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.92 1.288 . . . . 0.0 111.201 -176.294 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 29.1 tt0 -82.91 127.93 33.97 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 123.999 0.919 . . . . 0.0 109.941 174.354 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 85.0 mt -130.34 139.98 50.65 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 125.234 1.413 . . . . 0.0 111.696 -179.248 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 3.7 tmtt? -110.07 145.93 36.24 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 125.716 1.607 . . . . 0.0 110.048 168.085 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -54.54 96.06 0.01 OUTLIER 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 124.527 1.131 . . . . 0.0 112.085 173.113 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 134.01 -10.71 4.8 Favored Glycine 0 CA--C 1.536 1.377 0 C-N-CA 126.948 2.213 . . . . 0.0 114.717 -175.72 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 79.8 m-20 -77.88 127.35 32.25 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 114.962 1.467 . . . . 0.0 114.962 -170.272 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 1.9 t -77.27 135.94 25.45 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.827 0 N-CA-C 113.235 0.828 . . . . 0.0 113.235 167.899 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 1.4 t -124.59 121.91 62.55 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.358 0 C-N-CA 125.97 1.708 . . . . 0.0 110.996 175.843 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 548' ' ' LEU . . . . . 0.418 ' CD2' ' HE2' ' A' ' 524' ' ' LYS . 18.4 mt -77.22 101.98 6.45 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 108.212 -1.033 . . . . 0.0 108.212 172.202 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 549' ' ' VAL . . . . . . . . . . . . . 7.5 t -64.25 133.58 29.71 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.23 0 N-CA-C 114.548 1.314 . . . . 0.0 114.548 173.694 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 14.9 pt -130.2 159.27 71.2 Favored Pre-proline 0 CA--C 1.544 0.735 0 C-N-CA 126.728 2.011 . . . . 0.0 109.595 -178.348 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -71.1 141.72 40.47 Favored 'Trans proline' 0 C--O 1.24 0.62 0 C-N-CA 123.16 2.573 . . . . 0.0 111.83 175.848 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 45.4 m-85 . . . . . 0 C--O 1.236 0.345 0 N-CA-C 115.179 1.548 . . . . 0.0 115.179 166.455 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 40.7 tt0 . . . . . 0 CA--C 1.532 0.279 0 CA-C-O 121.781 0.801 . . . . 0.0 112.503 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 53.6 m-20 -85.31 142.3 29.44 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.884 1.274 . . . . 0.0 112.529 171.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 52.6 tp10 -78.36 131.81 37.14 Favored 'General case' 0 N--CA 1.469 0.512 0 O-C-N 120.292 -1.505 . . . . 0.0 111.368 -170.36 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 80.61 -4.05 71.0 Favored Glycine 0 CA--C 1.537 1.442 0 O-C-N 121.636 -0.665 . . . . 0.0 114.37 -173.133 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 47.5 m95 -89.75 165.27 14.27 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.21 1.404 . . . . 0.0 112.654 172.721 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 14.4 mt -134.87 154.82 51.5 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 125.545 1.538 . . . . 0.0 110.004 167.663 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 35.8 tpp -110.68 142.24 42.85 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 125.188 1.395 . . . . 0.0 110.863 171.651 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -165.07 -174.62 34.96 Favored Glycine 0 CA--C 1.526 0.744 0 O-C-N 121.336 -0.852 . . . . 0.0 113.561 174.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 13.0 p -130.62 139.71 50.58 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 C-N-CA 125.026 1.33 . . . . 0.0 108.8 169.341 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 36.3 mtmt -57.07 137.05 56.29 Favored 'General case' 0 N--CA 1.467 0.375 0 O-C-N 121.4 -0.813 . . . . 0.0 111.36 176.205 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 47.5 tt0 -60.96 -38.9 87.52 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-O 118.411 -0.804 . . . . 0.0 111.126 178.44 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 61.8 m -68.96 -31.91 71.12 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 119.504 1.047 . . . . 0.0 113.495 175.934 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 -65.57 -42.71 91.49 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 122.473 1.13 . . . . 0.0 113.924 170.057 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 46.9 t-105 -78.05 -27.58 48.75 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.668 1.187 . . . . 0.0 113.832 178.803 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 5.3 t-20 -67.04 -34.05 76.86 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 119.724 1.147 . . . . 0.0 110.98 173.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 39.3 mt-30 -73.83 -11.0 60.24 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 113.909 1.077 . . . . 0.0 113.909 165.492 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 68.7 m-70 56.68 38.44 29.54 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.434 1.494 . . . . 0.0 113.339 -178.252 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 62.5 mttt -60.82 162.82 6.31 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 125.221 1.409 . . . . 0.0 112.52 172.051 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -48.49 95.41 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 126.947 2.099 . . . . 0.0 113.867 174.786 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 49.9 tp -52.85 -47.8 67.52 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 125.801 1.64 . . . . 0.0 111.933 -169.744 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -63.33 -20.7 65.73 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 125.333 1.453 . . . . 0.0 114.601 -175.166 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 32.7 mmtp -102.73 -43.35 5.6 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.288 1.035 . . . . 0.0 111.756 176.218 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 62.1 m -63.22 -30.94 71.99 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 113.907 1.077 . . . . 0.0 113.907 176.48 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 2.7 ptt85 -62.57 166.1 5.65 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-O 122.32 1.057 . . . . 0.0 113.151 175.498 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -177.94 171.0 43.48 Favored Glycine 0 CA--C 1.524 0.646 0 CA-C-N 114.22 -1.355 . . . . 0.0 113.275 170.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 31.7 m -87.44 145.27 7.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 C-N-CA 124.983 1.313 . . . . 0.0 110.394 171.098 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 44.2 p90 -141.23 155.37 68.06 Favored Pre-proline 0 C--O 1.24 0.579 0 C-N-CA 124.115 0.966 . . . . 0.0 113.285 175.652 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -66.82 108.56 1.49 Allowed 'Trans proline' 0 N--CA 1.458 -0.561 0 C-N-CA 122.245 1.963 . . . . 0.0 109.489 169.515 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 17.7 pt-20 -55.5 -27.64 49.82 Favored 'General case' 0 N--CA 1.475 0.776 0 O-C-N 121.457 -0.777 . . . . 0.0 112.588 -177.533 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 11.5 p-10 -67.13 -21.66 65.82 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 125.967 1.707 . . . . 0.0 113.872 178.177 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 13.4 m-85 -68.53 -15.35 63.51 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 116.412 2.004 . . . . 0.0 116.412 166.407 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 589' ' ' THR . . . . . . . . . . . . . 62.7 p -120.62 174.85 6.31 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 126.065 1.746 . . . . 0.0 111.18 -177.473 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -135.64 139.77 44.02 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.886 0.874 . . . . 0.0 109.802 171.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -61.13 134.2 56.8 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 126.851 2.06 . . . . 0.0 112.157 -177.573 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 592' ' ' VAL . . . . . . . . . . . . . 3.5 m . . . . . 0 CA--C 1.546 0.806 0 C-N-CA 124.169 0.988 . . . . 0.0 109.854 177.295 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 78.9 Cg_endo . . . . . 0 CA--C 1.539 0.754 0 CA-C-O 122.064 0.777 . . . . 0.0 113.616 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 47.0 t -136.28 134.62 49.95 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.94 0 C-N-CA 126.294 1.837 . . . . 0.0 109.643 178.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -67.52 142.56 96.37 Favored Pre-proline 0 CA--C 1.551 0.991 0 N-CA-C 112.882 0.697 . . . . 0.0 112.882 -173.551 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -73.71 162.13 40.3 Favored 'Trans proline' 0 CA--C 1.539 0.731 0 C-N-CA 122.762 2.308 . . . . 0.0 111.861 176.385 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo . . . . . 0 CA--C 1.539 0.76 0 C-N-CA 122.812 2.341 . . . . 0.0 112.179 178.676 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 10.0 mt . . . . . 0 CA--C 1.544 0.718 0 N-CA-C 112.343 0.498 . . . . 0.0 112.343 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -66.91 160.39 47.2 Favored 'Trans proline' 0 CA--C 1.538 0.695 0 C-N-CA 123.755 2.97 . . . . 0.0 113.581 -173.774 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -63.99 135.67 48.84 Favored 'Trans proline' 0 N--CA 1.456 -0.732 0 C-N-CA 123.135 2.557 . . . . 0.0 109.787 178.997 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 70.6 1.57 38.29 Favored Glycine 0 CA--C 1.535 1.314 0 CA-C-O 116.693 -2.17 . . . . 0.0 116.306 -176.299 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 30.5 t80 -35.61 135.84 0.26 Allowed 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 117.573 2.434 . . . . 0.0 117.573 -178.631 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 44.9 mtm -103.99 -64.64 1.08 Allowed 'General case' 0 C--O 1.237 0.406 0 C-N-CA 123.271 0.628 . . . . 0.0 111.595 179.872 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 523' ' ' PHE . . . . . . . . . . . . . 41.6 p90 -158.78 174.55 14.85 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 124.781 1.232 . . . . 0.0 112.881 -175.39 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 524' ' ' LYS . . . . . 0.536 ' HE2' ' CD2' ' A' ' 548' ' ' LEU . 78.8 mttt -108.0 160.93 15.4 Favored 'General case' 0 N--CA 1.472 0.661 0 O-C-N 121.173 -0.954 . . . . 0.0 112.593 173.524 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 16.7 m -136.5 159.7 37.86 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 C-N-CA 126.698 1.999 . . . . 0.0 109.926 167.385 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 60.7 tt0 -122.55 130.88 53.5 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 124.031 0.932 . . . . 0.0 112.591 169.749 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 527' ' ' ALA . . . . . . . . . . . . . . . -63.44 121.42 13.78 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.753 1.221 . . . . 0.0 112.613 178.289 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 60.6 mm-40 -84.32 -22.75 30.53 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.345 1.458 . . . . 0.0 111.986 172.974 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 97.7 m-70 -142.72 161.88 36.93 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 126.418 1.887 . . . . 0.0 111.135 -168.672 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -87.8 123.39 32.54 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.981 1.712 . . . . 0.0 115.344 -179.729 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 78.2 t80 -130.56 113.45 14.25 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 124.33 1.052 . . . . 0.0 112.148 -176.241 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 1.2 m -89.33 127.07 35.76 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 124.636 1.175 . . . . 0.0 114.075 169.561 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -74.13 132.12 41.95 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-O 122.545 1.165 . . . . 0.0 112.778 -173.912 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 534' ' ' THR . . . . . . . . . . . . 0.289 3.3 t -108.97 14.88 23.82 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 126.214 1.806 . . . . 0.0 114.624 -177.928 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 24.9 t0 -150.7 159.34 44.58 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.86 1.264 . . . . 0.0 108.074 175.837 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 1.4 t -72.54 -10.43 59.78 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 115.01 1.485 . . . . 0.0 115.01 167.45 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 95.4 m-20 -76.64 -25.24 53.6 Favored 'General case' 0 N--CA 1.47 0.547 0 N-CA-C 116.379 1.992 . . . . 0.0 116.379 162.968 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 70.6 mt-10 -87.17 153.64 21.35 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 114.229 1.196 . . . . 0.0 114.229 -166.598 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -100.04 129.35 46.08 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 126.91 2.084 . . . . 0.0 110.051 176.549 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 18.4 tt0 -80.43 130.27 35.05 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.474 0.709 . . . . 0.0 110.198 173.183 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 78.2 mt -124.58 146.64 48.93 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 124.771 1.229 . . . . 0.0 111.067 176.721 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -116.77 149.21 40.3 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 124.474 1.11 . . . . 0.0 109.403 167.071 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -54.29 105.91 0.17 Allowed 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 123.233 0.613 . . . . 0.0 111.753 176.097 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 121.31 -8.64 10.32 Favored Glycine 0 CA--C 1.534 1.25 0 C-N-CA 126.678 2.085 . . . . 0.0 114.1 -177.826 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 84.6 m-20 -78.91 123.91 27.73 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 119.414 1.607 . . . . 0.0 114.757 -172.679 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 2.4 t -73.17 138.8 20.62 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 C-N-CA 123.74 0.816 . . . . 0.0 112.049 171.816 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -129.13 124.69 61.11 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.41 0 C-N-CA 125.192 1.397 . . . . 0.0 111.594 176.567 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 548' ' ' LEU . . . . . 0.536 ' CD2' ' HE2' ' A' ' 524' ' ' LYS . 17.3 mt -81.23 98.27 8.02 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.568 1.147 . . . . 0.0 108.134 176.252 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 549' ' ' VAL . . . . . . . . . . . . . 3.0 t -57.74 125.05 13.12 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.111 0 N-CA-C 113.548 0.944 . . . . 0.0 113.548 169.579 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 6.0 pt -122.76 157.53 59.51 Favored Pre-proline 0 N--CA 1.473 0.722 0 C-N-CA 126.641 1.976 . . . . 0.0 108.981 178.437 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -63.83 149.62 90.29 Favored 'Trans proline' 0 N--CA 1.461 -0.41 0 C-N-CA 122.635 2.223 . . . . 0.0 110.272 173.863 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 552' ' ' PHE . . . . . 0.437 ' CE1' ' HA ' ' A' ' 558' ' ' GLN . 29.3 m-85 . . . . . 0 C--N 1.33 -0.26 0 N-CA-C 116.188 1.921 . . . . 0.0 116.188 179.699 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 558' ' ' GLN . . . . . 0.437 ' HA ' ' CE1' ' A' ' 552' ' ' PHE . 40.6 tt0 . . . . . 0 C--O 1.236 0.387 0 N-CA-C 113.782 1.03 . . . . 0.0 113.782 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -125.93 144.26 50.76 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 125.005 1.322 . . . . 0.0 108.665 -170.954 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -77.64 129.9 36.16 Favored 'General case' 0 N--CA 1.475 0.782 0 O-C-N 120.205 -1.559 . . . . 0.0 112.666 -171.35 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 81.41 -0.42 87.84 Favored Glycine 0 CA--C 1.539 1.543 0 C-N-CA 124.37 0.986 . . . . 0.0 114.703 -172.967 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 54.0 m95 -102.59 162.69 12.73 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 126.789 2.036 . . . . 0.0 112.508 175.14 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 11.1 mt -138.74 154.86 48.57 Favored 'General case' 0 N--CA 1.472 0.655 0 O-C-N 121.146 -0.971 . . . . 0.0 110.894 172.864 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 48.3 ttm -112.79 139.88 48.04 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 124.983 1.313 . . . . 0.0 111.718 -179.164 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -170.08 -174.77 38.52 Favored Glycine 0 CA--C 1.522 0.528 0 C-N-CA 124.292 0.948 . . . . 0.0 112.732 178.264 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 13.8 p -128.24 140.29 49.6 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.493 0 C-N-CA 125.48 1.512 . . . . 0.0 109.118 170.416 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 36.3 mtmt -59.89 136.17 57.92 Favored 'General case' 0 N--CA 1.465 0.317 0 O-C-N 121.459 -0.775 . . . . 0.0 111.056 176.694 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -57.94 -40.55 80.78 Favored 'General case' 0 C--O 1.22 -0.453 0 CA-C-O 118.096 -0.954 . . . . 0.0 110.558 176.927 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 52.3 m -59.32 -44.05 92.63 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 119.903 1.228 . . . . 0.0 113.017 175.11 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -62.64 -35.2 78.85 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 115.336 1.606 . . . . 0.0 115.336 173.465 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 69.6 t-105 -79.54 -31.86 42.13 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.63 1.172 . . . . 0.0 113.332 175.476 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 21.8 t-20 -71.69 -30.23 65.45 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 126.332 1.853 . . . . 0.0 111.845 177.913 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 50.6 mt-30 -83.11 3.49 30.45 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 114.022 1.119 . . . . 0.0 114.022 171.127 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 55.3 m-70 57.93 30.18 18.74 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 126.316 1.846 . . . . 0.0 114.148 178.963 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 45.5 mttt -68.01 161.54 26.41 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 124.838 1.255 . . . . 0.0 111.351 174.296 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 20.0 pt-20 -56.4 105.92 0.24 Allowed 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 124.654 1.181 . . . . 0.0 114.122 -177.64 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 42.5 tp -54.39 -48.86 71.06 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 125.094 1.357 . . . . 0.0 112.14 -173.827 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 21.1 pm0 -59.05 -18.83 38.39 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 126.301 1.84 . . . . 0.0 114.974 -177.508 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 66.7 mmtt -124.74 -8.68 7.31 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 115.606 1.706 . . . . 0.0 115.606 177.403 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 97.9 m -80.16 -32.34 38.82 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 123.984 0.914 . . . . 0.0 112.27 163.422 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 36.4 ptt180 -61.61 157.12 18.17 Favored 'General case' 0 N--CA 1.474 0.733 0 O-C-N 121.378 -0.826 . . . . 0.0 112.724 174.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -170.2 174.86 44.3 Favored Glycine 0 CA--C 1.524 0.634 0 C-N-CA 124.643 1.116 . . . . 0.0 113.139 174.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 21.5 m -93.77 142.67 12.96 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 C-N-CA 124.553 1.141 . . . . 0.0 111.682 169.427 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 38.9 p90 -136.18 154.48 77.36 Favored Pre-proline 0 CA--C 1.539 0.525 0 C-N-CA 125.057 1.343 . . . . 0.0 112.863 176.699 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -66.21 112.85 2.43 Favored 'Trans proline' 0 N--CA 1.457 -0.65 0 C-N-CA 121.62 1.547 . . . . 0.0 108.845 169.57 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 22.1 pt-20 -52.73 -33.35 47.62 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 123.265 0.626 . . . . 0.0 111.821 -179.37 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 9.8 p-10 -69.99 -10.84 60.01 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 127.473 2.309 . . . . 0.0 114.636 -178.637 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 16.5 m-85 -77.24 -11.68 59.86 Favored 'General case' 0 N--CA 1.468 0.466 0 N-CA-C 116.82 2.155 . . . . 0.0 116.82 162.199 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 589' ' ' THR . . . . . . . . . . . . . 67.8 p -129.82 170.47 13.84 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 125.992 1.717 . . . . 0.0 111.779 -174.272 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -131.36 137.49 48.76 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 124.162 0.985 . . . . 0.0 110.74 175.985 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 12.9 tpt180 -56.98 135.12 56.21 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 126.366 1.866 . . . . 0.0 112.023 177.388 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 592' ' ' VAL . . . . . . . . . . . . . 2.1 m . . . . . 0 N--CA 1.481 1.084 0 C-N-CA 125.975 1.71 . . . . 0.0 109.304 176.13 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo . . . . . 0 CA--C 1.539 0.761 0 N-CA-C 114.459 0.907 . . . . 0.0 114.459 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 65.6 t -129.86 133.82 64.07 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.842 0 C-N-CA 126.268 1.827 . . . . 0.0 109.709 177.379 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -68.51 132.22 91.29 Favored Pre-proline 0 CA--C 1.549 0.912 0 O-C-N 121.651 -0.655 . . . . 0.0 111.887 179.764 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -75.78 167.0 27.19 Favored 'Trans proline' 0 CA--C 1.544 0.979 0 C-N-CA 122.134 1.889 . . . . 0.0 112.019 -177.503 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 73.8 Cg_exo . . . . . 0 C--N 1.347 0.5 0 C-N-CA 124.012 3.141 . . . . 0.0 112.654 169.931 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 10.4 mt . . . . . 0 CA--C 1.537 0.475 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -65.52 158.22 54.17 Favored 'Trans proline' 0 CA--C 1.537 0.674 0 C-N-CA 123.882 3.055 . . . . 0.0 113.756 -169.482 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -62.2 133.42 43.61 Favored 'Trans proline' 0 N--CA 1.456 -0.733 0 C-N-CA 123.306 2.671 . . . . 0.0 109.809 177.705 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 75.13 3.17 68.52 Favored Glycine 0 CA--C 1.534 1.247 0 CA-C-O 117.73 -1.594 . . . . 0.0 115.432 -175.347 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 37.2 t80 -42.6 125.55 3.34 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 121.024 2.412 . . . . 0.0 116.21 178.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 60.5 mtm -97.06 -47.76 5.66 Favored 'General case' 0 N--CA 1.471 0.575 0 C-N-CA 123.782 0.833 . . . . 0.0 112.546 -177.195 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 523' ' ' PHE . . . . . . . . . . . . . 23.8 p90 -171.15 167.19 7.15 Favored 'General case' 0 C--O 1.223 -0.321 0 C-N-CA 128.177 2.591 . . . . 0.0 112.504 -176.404 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 524' ' ' LYS . . . . . 0.521 ' HE2' ' CD2' ' A' ' 548' ' ' LEU . 85.1 mttt -96.9 160.71 14.2 Favored 'General case' 0 N--CA 1.47 0.539 0 O-C-N 120.871 -1.143 . . . . 0.0 111.653 165.365 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 16.4 m -133.09 161.36 41.69 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 C-N-CA 125.334 1.453 . . . . 0.0 109.959 163.18 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 43.8 tt0 -128.33 128.92 45.49 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 124.009 0.923 . . . . 0.0 111.875 174.841 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 527' ' ' ALA . . . . . . . . . . . . . . . -62.83 123.52 18.69 Favored 'General case' 0 CA--C 1.538 0.484 0 O-C-N 121.547 -0.721 . . . . 0.0 111.576 -178.584 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 42.3 mm-40 -87.24 -32.96 19.48 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 124.785 1.234 . . . . 0.0 110.044 168.888 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 97.6 m-70 -130.54 153.66 48.62 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 126.54 1.936 . . . . 0.0 110.798 179.039 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -79.42 141.6 36.69 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 125.276 1.43 . . . . 0.0 113.182 176.566 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 86.4 t80 -134.0 128.2 33.88 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 115.397 1.629 . . . . 0.0 115.397 -174.974 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -92.9 112.13 23.98 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 116.268 1.951 . . . . 0.0 116.268 177.983 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -67.7 130.69 43.78 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 123.835 0.854 . . . . 0.0 111.026 171.81 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 534' ' ' THR . . . . . . . . . . . . 0.259 12.1 t -136.39 31.23 2.89 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 125.946 1.698 . . . . 0.0 112.694 179.739 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 41.1 t0 -146.66 169.99 17.87 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 125.086 1.354 . . . . 0.0 109.056 167.364 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 1.1 t -67.6 -26.77 66.43 Favored 'General case' 0 N--CA 1.47 0.536 0 N-CA-C 115.871 1.804 . . . . 0.0 115.871 168.048 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 35.6 t0 -76.51 -27.71 56.13 Favored 'General case' 0 CA--C 1.547 0.852 0 O-C-N 121.069 -1.02 . . . . 0.0 110.887 178.363 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 60.3 mt-10 -80.76 149.29 29.71 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 115.404 1.631 . . . . 0.0 115.404 -164.596 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -101.62 137.88 39.35 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 128.967 2.907 . . . . 0.0 109.866 174.506 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 19.9 tt0 -95.47 134.95 37.73 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 123.994 0.917 . . . . 0.0 111.064 175.892 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 80.1 mt -125.68 148.1 49.13 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.388 1.075 . . . . 0.0 112.647 -178.189 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 3.1 tppp? -113.57 141.31 47.33 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 126.85 2.06 . . . . 0.0 109.497 164.491 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -52.47 114.02 1.24 Allowed 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 119.025 0.829 . . . . 0.0 110.982 173.575 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 115.61 -15.41 17.18 Favored Glycine 0 CA--C 1.529 0.936 0 C-N-CA 126.024 1.773 . . . . 0.0 113.463 -173.161 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 78.3 m-20 -66.83 118.63 10.61 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 118.953 1.377 . . . . 0.0 113.873 -178.037 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 45.9 t -72.53 134.75 29.22 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 166.791 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -127.49 123.08 60.82 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.386 0 C-N-CA 125.856 1.662 . . . . 0.0 111.184 175.86 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 548' ' ' LEU . . . . . 0.521 ' CD2' ' HE2' ' A' ' 524' ' ' LYS . 22.3 mt -81.39 98.84 8.39 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.894 1.278 . . . . 0.0 108.393 178.438 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 549' ' ' VAL . . . . . . . . . . . . . 3.4 t -62.43 131.97 27.98 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.236 0 N-CA-C 114.772 1.397 . . . . 0.0 114.772 175.812 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 18.2 pt -133.24 158.24 76.23 Favored Pre-proline 0 CA--C 1.551 1.011 0 C-N-CA 127.134 2.173 . . . . 0.0 109.935 177.859 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 82.8 Cg_endo -71.16 154.51 62.01 Favored 'Trans proline' 0 CA--C 1.537 0.626 0 C-N-CA 124.031 3.154 . . . . 0.0 112.016 174.639 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 24.5 m-85 . . . . . 0 CA--C 1.538 0.486 0 N-CA-C 116.747 2.129 . . . . 0.0 116.747 -174.728 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 42.7 tt0 . . . . . 0 N--CA 1.469 0.49 0 N-CA-C 113.053 0.76 . . . . 0.0 113.053 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 50.6 m-20 -90.84 128.65 36.81 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 126.012 1.725 . . . . 0.0 110.886 -179.246 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 6.0 tm-20 -65.04 135.1 55.19 Favored 'General case' 0 N--CA 1.475 0.814 0 O-C-N 120.358 -1.464 . . . . 0.0 111.608 -178.701 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 80.51 -5.72 63.42 Favored Glycine 0 CA--C 1.538 1.524 0 C-N-CA 124.25 0.928 . . . . 0.0 115.229 -174.651 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 48.0 m95 -93.95 167.15 11.79 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 125.199 1.4 . . . . 0.0 112.87 172.846 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 16.8 mt -134.36 160.15 38.83 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 124.49 1.116 . . . . 0.0 110.328 165.177 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 38.1 ttm -114.77 143.45 45.06 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 124.976 1.31 . . . . 0.0 111.307 175.503 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -170.58 -172.5 36.99 Favored Glycine 0 CA--C 1.523 0.586 0 CA-C-O 121.687 0.604 . . . . 0.0 113.304 176.288 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 14.5 p -132.54 136.91 55.29 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 C-N-CA 125.595 1.558 . . . . 0.0 109.214 173.226 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 40.4 mtmt -62.86 137.85 58.38 Favored 'General case' 0 N--CA 1.465 0.318 0 O-C-N 121.085 -1.009 . . . . 0.0 111.805 178.758 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 71.2 tt0 -58.04 -44.89 87.64 Favored 'General case' 0 C--O 1.222 -0.356 0 CA-C-O 118.268 -0.872 . . . . 0.0 110.866 -178.15 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 10.5 t -63.92 -26.5 68.62 Favored 'General case' 0 CA--C 1.546 0.79 0 CA-C-N 119.735 1.152 . . . . 0.0 112.983 -177.427 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -72.84 -48.23 39.49 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 126.69 1.996 . . . . 0.0 109.452 175.951 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 64.6 t-105 -67.64 -30.3 69.82 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.443 1.497 . . . . 0.0 113.003 176.154 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 33.8 t-20 -76.17 -25.68 55.48 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 127.009 2.124 . . . . 0.0 112.202 175.869 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 32.0 mt-30 -80.1 3.22 21.12 Favored 'General case' 0 CA--C 1.546 0.797 0 N-CA-C 113.375 0.88 . . . . 0.0 113.375 160.351 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 95.0 m-70 54.38 34.43 20.73 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 126.241 1.816 . . . . 0.0 114.491 175.697 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 5.6 mtpm? -75.05 158.17 33.61 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 125.289 1.436 . . . . 0.0 111.758 178.092 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 8.1 pm0 -53.18 108.83 0.36 Allowed 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.738 1.615 . . . . 0.0 114.37 -176.707 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 64.0 tp -57.0 -47.29 81.19 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 125.197 1.399 . . . . 0.0 112.945 -170.041 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 56.6 mt-10 -68.13 -24.07 64.97 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 114.488 1.292 . . . . 0.0 114.488 -174.852 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 43.1 mmtm -85.52 -47.05 10.27 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 123.618 0.767 . . . . 0.0 111.816 168.692 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 89.5 m -67.45 -28.53 67.96 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 114.381 1.252 . . . . 0.0 114.381 -172.13 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 36.2 ptt180 -64.63 163.27 14.07 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 124.635 1.174 . . . . 0.0 113.505 175.428 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -171.63 172.9 44.85 Favored Glycine 0 CA--C 1.531 1.057 0 C-N-CA 125.092 1.33 . . . . 0.0 114.27 174.449 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 14.7 m -91.67 143.97 10.2 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.61 0 C-N-CA 125.522 1.529 . . . . 0.0 112.639 170.847 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 49.3 p90 -142.25 155.59 64.69 Favored Pre-proline 0 CA--C 1.545 0.778 0 C-N-CA 124.876 1.27 . . . . 0.0 112.91 176.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_endo -69.08 110.3 2.38 Favored 'Trans proline' 0 C--N 1.348 0.548 0 C-N-CA 122.453 2.102 . . . . 0.0 109.973 171.651 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -57.3 -25.1 58.76 Favored 'General case' 0 N--CA 1.474 0.761 0 O-C-N 121.311 -0.868 . . . . 0.0 113.273 -179.364 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 8.7 p-10 -70.24 -9.51 56.1 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.33 1.452 . . . . 0.0 114.464 176.726 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 18.6 m-85 -80.22 -12.64 59.61 Favored 'General case' 0 CA--C 1.539 0.539 0 N-CA-C 116.668 2.099 . . . . 0.0 116.668 164.949 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 589' ' ' THR . . . . . . . . . . . . . 39.4 p -127.26 176.87 7.08 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 125.543 1.537 . . . . 0.0 110.591 -170.727 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 16.7 pt-20 -134.67 147.98 50.25 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 124.96 1.304 . . . . 0.0 110.747 173.085 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 2.7 tmm_? -60.21 136.85 58.15 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 124.631 1.173 . . . . 0.0 112.812 173.054 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 592' ' ' VAL . . . . . . . . . . . . . 1.1 m . . . . . 0 CA--C 1.549 0.909 0 C-N-CA 126.752 2.021 . . . . 0.0 109.302 177.099 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo . . . . . 0 CA--C 1.544 0.988 0 CA-C-O 122.034 0.764 . . . . 0.0 114.065 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 7.7 p -139.82 136.27 38.98 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 C-N-CA 125.3 1.44 . . . . 0.0 111.815 179.634 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -70.24 141.76 89.09 Favored Pre-proline 0 CA--C 1.553 1.081 0 O-C-N 121.496 -0.752 . . . . 0.0 112.915 -176.276 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -74.37 163.88 35.3 Favored 'Trans proline' 0 CA--C 1.543 0.93 0 C-N-CA 122.804 2.336 . . . . 0.0 111.947 174.329 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo . . . . . 0 CA--C 1.541 0.862 0 C-N-CA 122.581 2.187 . . . . 0.0 112.116 179.396 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 18.0 mt . . . . . 0 CA--C 1.547 0.832 0 N-CA-C 113.731 1.012 . . . . 0.0 113.731 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 34.8 Cg_endo -67.3 161.07 44.72 Favored 'Trans proline' 0 CA--C 1.54 0.805 0 C-N-CA 124.296 3.331 . . . . 0.0 114.298 -173.72 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -63.87 128.26 21.54 Favored 'Trans proline' 0 C--N 1.35 0.616 0 C-N-CA 123.065 2.51 . . . . 0.0 110.414 -178.623 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 75.34 3.9 72.26 Favored Glycine 0 CA--C 1.534 1.221 0 CA-C-O 117.425 -1.764 . . . . 0.0 115.367 -177.246 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 31.7 t80 -36.17 132.19 0.56 Allowed 'General case' 0 CA--C 1.545 0.763 0 N-CA-C 117.387 2.366 . . . . 0.0 117.387 177.168 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 38.0 mtm -100.06 -56.55 2.34 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 123.848 0.859 . . . . 0.0 112.437 -177.195 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 523' ' ' PHE . . . . . . . . . . . . . 28.6 p90 -167.06 168.18 13.93 Favored 'General case' 0 C--O 1.225 -0.229 0 C-N-CA 127.44 2.296 . . . . 0.0 112.245 -172.279 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 524' ' ' LYS . . . . . 0.424 ' HE2' ' CD2' ' A' ' 548' ' ' LEU . 82.2 mttt -103.1 163.61 12.12 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 121.135 -0.978 . . . . 0.0 111.356 171.331 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 12.0 m -134.26 160.5 41.62 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.813 0 C-N-CA 126.889 2.076 . . . . 0.0 109.331 165.268 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 48.0 tt0 -124.06 128.26 49.07 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-N 119.618 1.099 . . . . 0.0 112.324 170.236 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 527' ' ' ALA . . . . . . . . . . . . . . . -60.62 123.91 18.83 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 124.401 1.081 . . . . 0.0 111.105 178.049 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 76.5 mm-40 -85.39 -37.6 19.68 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 125.448 1.499 . . . . 0.0 111.104 171.103 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 81.3 m-70 -127.63 155.59 43.65 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 127.025 2.13 . . . . 0.0 109.438 176.624 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -82.19 151.29 26.96 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 107.41 -1.33 . . . . 0.0 107.41 178.387 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 94.1 t80 -137.88 113.82 9.89 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 125.099 1.36 . . . . 0.0 113.288 -178.609 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 2.0 m -86.36 118.89 26.09 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 124.405 1.082 . . . . 0.0 113.45 172.696 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -70.22 146.58 50.6 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 124.896 1.278 . . . . 0.0 113.077 -179.864 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 14.5 t -102.01 -31.78 10.48 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 125.314 1.446 . . . . 0.0 113.381 171.111 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 87.2 m-20 -108.08 155.32 20.52 Favored 'General case' 0 N--CA 1.47 0.544 0 N-CA-C 116.808 2.151 . . . . 0.0 116.808 -172.389 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 4.3 t -65.91 -13.3 59.43 Favored 'General case' 0 N--CA 1.483 1.198 0 N-CA-C 116.51 2.041 . . . . 0.0 116.51 -178.547 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . 0.298 63.6 m-20 -113.75 2.53 15.21 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 117.114 2.265 . . . . 0.0 117.114 167.6 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 53.0 mt-10 -74.22 142.84 45.34 Favored 'General case' 0 CA--C 1.541 0.619 0 O-C-N 120.253 -1.53 . . . . 0.0 111.412 167.09 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -89.62 130.98 35.84 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 126.133 1.773 . . . . 0.0 109.643 176.21 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 14.7 tt0 -85.19 131.25 34.46 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 121.677 -0.639 . . . . 0.0 111.422 173.054 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 75.0 mt -121.11 151.1 40.26 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 124.423 1.089 . . . . 0.0 112.631 179.004 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 6.8 tmtt? -116.85 140.57 49.29 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 126.322 1.849 . . . . 0.0 109.753 169.496 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -53.9 106.6 0.2 Allowed 'General case' 0 CA--C 1.548 0.875 0 CA-C-N 119.12 0.873 . . . . 0.0 110.968 175.515 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 114.63 -6.84 22.44 Favored Glycine 0 CA--C 1.538 1.48 0 C-N-CA 125.518 1.533 . . . . 0.0 114.743 -172.943 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -65.5 118.97 10.22 Favored 'General case' 0 CA--C 1.519 -0.227 0 CA-C-N 119.503 1.651 . . . . 0.0 113.723 174.613 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 2.8 t -70.63 134.52 29.9 Favored 'Isoleucine or valine' 0 C--O 1.236 0.352 0 C-N-CA 120.656 -0.418 . . . . 0.0 110.252 159.208 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 1.1 t -123.32 124.47 69.94 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 C-N-CA 125.612 1.565 . . . . 0.0 110.93 175.388 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 548' ' ' LEU . . . . . 0.424 ' CD2' ' HE2' ' A' ' 524' ' ' LYS . 22.2 mt -83.75 99.15 10.08 Favored 'General case' 0 C--N 1.324 -0.541 0 C-N-CA 124.56 1.144 . . . . 0.0 108.216 179.293 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 549' ' ' VAL . . . . . . . . . . . . . 4.1 t -61.57 129.56 24.66 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.109 0 N-CA-C 114.052 1.131 . . . . 0.0 114.052 174.545 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 10.5 pt -124.18 153.73 68.38 Favored Pre-proline 0 CA--C 1.548 0.874 0 C-N-CA 126.44 1.896 . . . . 0.0 110.723 178.233 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -71.17 135.46 27.17 Favored 'Trans proline' 0 CA--C 1.534 0.508 0 C-N-CA 123.91 3.074 . . . . 0.0 111.296 178.56 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 552' ' ' PHE . . . . . 0.442 ' CE1' ' HA ' ' A' ' 558' ' ' GLN . 23.9 m-85 . . . . . 0 CA--C 1.534 0.341 0 N-CA-C 117.664 2.468 . . . . 0.0 117.664 -174.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 558' ' ' GLN . . . . . 0.442 ' HA ' ' CE1' ' A' ' 552' ' ' PHE . 40.0 tp60 . . . . . 0 N--CA 1.47 0.529 0 CA-C-O 122.154 0.978 . . . . 0.0 111.853 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . 0.256 6.6 m-20 -141.16 150.66 43.05 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 126.485 1.914 . . . . 0.0 114.525 174.661 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 51.3 tp10 -75.23 127.5 33.33 Favored 'General case' 0 N--CA 1.472 0.64 0 O-C-N 121.013 -1.054 . . . . 0.0 111.06 -173.492 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 82.18 -7.26 64.33 Favored Glycine 0 CA--C 1.538 1.518 0 C-N-CA 124.484 1.04 . . . . 0.0 114.255 -168.874 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 60.8 m95 -98.41 155.57 17.17 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.851 1.261 . . . . 0.0 112.897 178.927 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 6.8 mt -143.55 152.49 41.5 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 125.201 1.401 . . . . 0.0 110.493 176.475 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 55.7 ttm -110.45 140.28 44.85 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 124.275 1.03 . . . . 0.0 112.359 -179.587 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -172.69 -171.69 37.71 Favored Glycine 0 CA--C 1.524 0.641 0 C-N-CA 123.92 0.772 . . . . 0.0 113.237 -179.284 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 11.6 p -131.87 143.2 40.94 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.53 0 C-N-CA 125.131 1.372 . . . . 0.0 110.506 172.375 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 42.0 mtmt -57.94 131.49 50.58 Favored 'General case' 0 N--CA 1.467 0.397 0 O-C-N 121.615 -0.678 . . . . 0.0 111.704 175.08 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -62.49 -40.59 97.19 Favored 'General case' 0 C--O 1.223 -0.325 0 CA-C-O 118.281 -0.866 . . . . 0.0 110.548 176.543 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 26.6 t -58.74 -32.33 69.13 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 119.559 1.072 . . . . 0.0 112.291 177.003 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -76.77 -45.72 27.94 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 114.98 1.474 . . . . 0.0 114.98 177.038 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 56.2 t-105 -67.28 -39.15 85.97 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.85 1.26 . . . . 0.0 112.957 176.492 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 5.0 t-20 -64.17 -28.71 69.94 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 124.894 1.278 . . . . 0.0 111.201 176.061 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 39.4 mt-30 -92.0 7.17 43.42 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.429 1.492 . . . . 0.0 114.614 171.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 89.0 m-70 56.48 34.74 24.83 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 126.432 1.893 . . . . 0.0 114.449 176.508 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 62.2 mttt -73.78 155.77 38.51 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.452 1.101 . . . . 0.0 111.614 174.553 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 12.8 pm0 -57.03 102.93 0.09 Allowed 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 115.403 1.631 . . . . 0.0 115.403 -170.413 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 47.5 tp -53.0 -45.91 68.09 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 125.097 1.359 . . . . 0.0 112.165 -176.697 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 19.5 pt-20 -63.21 -16.14 59.24 Favored 'General case' 0 N--CA 1.479 0.999 0 N-CA-C 115.202 1.556 . . . . 0.0 115.202 -176.889 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 29.0 tptp -114.57 -37.0 4.4 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 125.927 1.691 . . . . 0.0 112.345 -178.987 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 47.9 t -70.23 -30.57 67.67 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.217 1.407 . . . . 0.0 112.885 176.965 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 30.9 ptt85 -60.58 158.64 12.0 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 124.174 0.989 . . . . 0.0 112.839 176.701 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -179.25 175.91 47.47 Favored Glycine 0 N--CA 1.461 0.337 0 CA-C-N 115.966 -0.561 . . . . 0.0 114.375 173.111 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 34.7 m -88.52 140.19 16.19 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 C-N-CA 124.317 1.047 . . . . 0.0 111.149 167.719 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 43.3 p90 -134.44 155.25 79.88 Favored Pre-proline 0 CA--C 1.538 0.503 0 C-N-CA 125.159 1.383 . . . . 0.0 112.565 173.552 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -66.31 113.58 2.72 Favored 'Trans proline' 0 CA--C 1.536 0.617 0 C-N-CA 122.427 2.085 . . . . 0.0 110.451 171.307 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 15.6 pt-20 -60.28 -26.09 66.22 Favored 'General case' 0 N--CA 1.475 0.786 0 O-C-N 121.108 -0.995 . . . . 0.0 112.03 -178.01 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 13.8 p-10 -71.37 -9.21 57.78 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 126.99 2.116 . . . . 0.0 114.444 177.005 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 14.0 m-85 -81.16 -14.09 57.98 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 116.714 2.116 . . . . 0.0 116.714 163.446 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 589' ' ' THR . . . . . . . . . . . . . 54.7 p -126.61 168.85 13.75 Favored 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 125.106 1.362 . . . . 0.0 110.453 -172.766 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -120.66 141.65 50.18 Favored 'General case' 0 N--CA 1.465 0.289 0 C-N-CA 123.489 0.716 . . . . 0.0 109.857 173.912 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.06 130.13 42.24 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 124.412 1.085 . . . . 0.0 109.157 174.732 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 592' ' ' VAL . . . . . . . . . . . . . 4.7 m . . . . . 0 N--CA 1.477 0.92 0 C-N-CA 125.186 1.394 . . . . 0.0 108.938 179.446 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 92.9 Cg_endo . . . . . 0 CA--C 1.54 0.805 0 CA-C-O 121.368 0.487 . . . . 0.0 112.186 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 51.8 t -137.17 134.0 47.35 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 C-N-CA 125.461 1.504 . . . . 0.0 110.313 177.479 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -68.14 133.0 91.7 Favored Pre-proline 0 CA--C 1.547 0.849 0 CA-C-O 118.237 -0.887 . . . . 0.0 111.608 -175.23 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 3.2 Cg_exo -65.07 166.49 18.56 Favored 'Trans proline' 0 CA--C 1.541 0.839 0 C-N-CA 122.69 2.26 . . . . 0.0 113.221 -178.611 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 36.9 Cg_exo . . . . . 0 CA--C 1.54 0.778 0 C-N-CA 122.998 2.465 . . . . 0.0 112.364 162.688 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 12.8 mt . . . . . 0 CA--C 1.544 0.732 0 N-CA-C 113.32 0.859 . . . . 0.0 113.32 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_endo -67.71 160.82 46.49 Favored 'Trans proline' 0 CA--C 1.543 0.97 0 C-N-CA 124.304 3.336 . . . . 0.0 114.622 -172.875 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 66.2 Cg_endo -64.07 133.53 38.77 Favored 'Trans proline' 0 C--N 1.349 0.558 0 C-N-CA 123.267 2.645 . . . . 0.0 110.488 177.56 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 73.8 0.61 55.99 Favored Glycine 0 CA--C 1.535 1.292 0 CA-C-O 117.36 -1.8 . . . . 0.0 115.386 -175.785 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 38.7 t80 -36.59 123.31 0.81 Allowed 'General case' 0 C--N 1.349 0.582 0 CA-C-N 120.717 2.258 . . . . 0.0 116.634 179.823 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 50.1 mtm -94.98 -54.2 3.54 Favored 'General case' 0 N--CA 1.465 0.316 0 C-N-CA 123.252 0.621 . . . . 0.0 111.28 -177.206 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 523' ' ' PHE . . . . . . . . . . . . . 24.9 p90 -167.96 167.16 12.93 Favored 'General case' 0 C--O 1.223 -0.314 0 C-N-CA 126.646 1.978 . . . . 0.0 113.085 -172.685 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 524' ' ' LYS . . . . . 0.448 ' HE2' ' CD2' ' A' ' 548' ' ' LEU . 80.6 mttt -100.26 161.74 13.41 Favored 'General case' 0 C--N 1.326 -0.433 0 O-C-N 121.3 -0.875 . . . . 0.0 111.039 167.616 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 18.0 m -136.86 154.88 32.27 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 C-N-CA 126.742 2.017 . . . . 0.0 108.794 167.833 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 44.6 tt0 -118.68 129.13 55.12 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 119.698 1.135 . . . . 0.0 111.261 173.063 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 527' ' ' ALA . . . . . . . . . . . . . . . -62.72 119.32 9.06 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 124.028 0.931 . . . . 0.0 112.181 -178.444 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 44.7 mm-40 -85.79 -15.31 42.44 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 125.734 1.614 . . . . 0.0 111.932 173.958 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 92.3 m-70 -147.75 156.87 43.2 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 126.067 1.747 . . . . 0.0 111.369 -172.512 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -81.91 124.22 29.54 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 125.416 1.486 . . . . 0.0 114.646 175.957 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 88.4 t80 -129.87 114.56 16.04 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 124.68 1.192 . . . . 0.0 112.333 -177.426 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -83.04 125.63 31.67 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 124.341 1.056 . . . . 0.0 113.425 171.856 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -64.39 137.58 57.97 Favored 'General case' 0 CA--C 1.537 0.474 0 O-C-N 121.293 -0.879 . . . . 0.0 110.48 175.708 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 534' ' ' THR . . . . . . . . . . . . 0.272 2.0 t -132.35 3.53 3.94 Favored 'General case' 0 N--CA 1.473 0.722 0 N-CA-C 115.501 1.667 . . . . 0.0 115.501 -173.211 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -136.09 159.43 41.75 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 126.834 2.054 . . . . 0.0 115.1 165.509 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 1.2 t -61.76 -12.18 15.76 Favored 'General case' 0 N--CA 1.476 0.833 0 N-CA-C 117.143 2.275 . . . . 0.0 117.143 -172.563 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 17.5 p30 -111.91 -0.79 15.69 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 127.716 2.406 . . . . 0.0 116.366 177.866 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 76.7 mt-10 -81.47 144.11 31.59 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 114.437 1.273 . . . . 0.0 114.437 -175.634 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -84.86 152.23 23.73 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 125.825 1.65 . . . . 0.0 109.945 171.133 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -119.3 128.21 53.93 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 125.101 1.36 . . . . 0.0 110.541 -176.734 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 74.4 mt -128.07 146.72 50.6 Favored 'General case' 0 N--CA 1.471 0.575 0 C-N-CA 124.761 1.224 . . . . 0.0 112.25 -168.935 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -120.35 143.46 48.38 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 126.86 2.064 . . . . 0.0 109.404 173.232 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -55.77 99.69 0.03 OUTLIER 'General case' 0 CA--C 1.552 1.021 0 CA-C-N 119.619 1.099 . . . . 0.0 112.533 178.889 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 125.99 -7.22 7.73 Favored Glycine 0 CA--C 1.537 1.461 0 C-N-CA 126.545 2.021 . . . . 0.0 115.174 -173.728 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 80.4 m-20 -73.04 121.75 20.65 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-N 120.18 1.99 . . . . 0.0 114.223 -177.609 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 4.1 t -73.36 133.99 30.6 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 CA-C-N 119.386 0.994 . . . . 0.0 111.373 165.306 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 1.4 t -119.74 124.63 73.19 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.516 0 C-N-CA 126.173 1.789 . . . . 0.0 111.048 172.492 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 548' ' ' LEU . . . . . 0.448 ' CD2' ' HE2' ' A' ' 524' ' ' LYS . 22.5 mt -80.28 98.63 7.49 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 174.637 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 549' ' ' VAL . . . . . . . . . . . . . 4.1 t -62.95 130.4 27.52 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 N-CA-C 114.449 1.277 . . . . 0.0 114.449 174.283 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 20.9 pt -127.3 157.65 71.9 Favored Pre-proline 0 CA--C 1.546 0.805 0 C-N-CA 127.034 2.134 . . . . 0.0 109.838 177.73 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo -71.05 154.27 62.64 Favored 'Trans proline' 0 CA--C 1.54 0.789 0 C-N-CA 123.358 2.705 . . . . 0.0 112.431 174.565 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 43.5 m-85 . . . . . 0 CA--C 1.537 0.463 0 N-CA-C 116.855 2.168 . . . . 0.0 116.855 177.994 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 40.6 tt0 . . . . . 0 CA--C 1.544 0.738 0 N-CA-C 113.995 1.109 . . . . 0.0 113.995 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -85.49 131.28 34.4 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.175 1.39 . . . . 0.0 109.158 -177.867 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 73.6 tt0 -60.66 130.74 48.01 Favored 'General case' 0 N--CA 1.472 0.654 0 O-C-N 121.014 -1.054 . . . . 0.0 111.68 178.023 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 84.89 -12.02 58.45 Favored Glycine 0 CA--C 1.532 1.148 0 C-N-CA 124.833 1.206 . . . . 0.0 114.966 -178.7 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 48.6 m95 -91.48 155.48 18.39 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 124.664 1.186 . . . . 0.0 113.048 178.98 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 14.1 mt -126.76 151.94 47.54 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 124.038 0.935 . . . . 0.0 110.455 170.345 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 56.5 ttm -109.84 143.4 39.78 Favored 'General case' 0 N--CA 1.464 0.243 0 C-N-CA 124.179 0.992 . . . . 0.0 111.003 174.842 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -170.9 -172.9 37.61 Favored Glycine 0 CA--C 1.524 0.597 0 C-N-CA 123.888 0.756 . . . . 0.0 112.765 177.898 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 14.1 p -133.63 139.61 48.44 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.487 0 C-N-CA 125.232 1.413 . . . . 0.0 108.79 170.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 36.4 mtmt -58.49 136.68 57.58 Favored 'General case' 0 N--CA 1.467 0.418 0 O-C-N 121.215 -0.928 . . . . 0.0 111.16 175.71 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 19.6 tt0 -61.73 -40.74 96.17 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 118.281 -0.866 . . . . 0.0 110.876 179.436 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 34.3 m -61.38 -35.62 77.99 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 119.456 1.025 . . . . 0.0 112.663 176.48 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 67.1 m-20 -68.34 -46.62 69.66 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 125.742 1.617 . . . . 0.0 115.067 174.351 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 53.4 t-105 -66.94 -33.63 76.0 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 124.315 1.046 . . . . 0.0 112.242 174.532 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 4.2 t-20 -73.35 -23.7 60.25 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.273 1.429 . . . . 0.0 112.672 172.097 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 38.3 mt-30 -77.17 0.25 22.46 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 125.046 1.338 . . . . 0.0 113.399 168.279 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 91.9 m-70 62.18 31.71 17.55 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.442 1.497 . . . . 0.0 113.483 172.94 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 79.1 mttt -76.72 157.58 31.61 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 126.046 1.738 . . . . 0.0 112.083 177.176 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -62.23 113.47 2.9 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 124.348 1.059 . . . . 0.0 113.145 174.426 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 59.6 tp -56.32 -42.74 78.14 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.465 1.506 . . . . 0.0 112.046 -178.814 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 23.9 pt-20 -68.95 -8.36 43.79 Favored 'General case' 0 N--CA 1.477 0.88 0 N-CA-C 115.06 1.504 . . . . 0.0 115.06 -173.778 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 34.8 mmtp -111.72 -41.35 4.07 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 124.72 1.208 . . . . 0.0 111.778 166.78 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 96.6 m -76.49 -17.47 59.27 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 115.059 1.503 . . . . 0.0 115.059 -172.18 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 20.4 ptt180 -65.13 163.85 14.22 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 125.011 1.324 . . . . 0.0 112.629 169.279 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -167.11 174.18 42.36 Favored Glycine 0 CA--C 1.526 0.754 0 CA-C-N 114.734 -1.121 . . . . 0.0 113.985 169.542 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 31.5 m -93.55 140.83 15.74 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.594 0 C-N-CA 124.748 1.219 . . . . 0.0 110.705 168.333 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 40.9 p90 -138.02 156.54 74.03 Favored Pre-proline 0 CA--C 1.543 0.684 0 C-N-CA 124.274 1.03 . . . . 0.0 113.245 177.291 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -66.97 111.89 2.33 Favored 'Trans proline' 0 CA--C 1.535 0.571 0 C-N-CA 122.629 2.219 . . . . 0.0 110.169 170.015 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 22.1 pt-20 -56.22 -29.83 61.51 Favored 'General case' 0 N--CA 1.475 0.821 0 O-C-N 121.309 -0.87 . . . . 0.0 112.5 -178.72 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 13.0 p-10 -69.2 -14.14 62.8 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 127.019 2.127 . . . . 0.0 113.867 -179.587 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 18.8 m-85 -75.21 -8.86 57.78 Favored 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 116.952 2.205 . . . . 0.0 116.952 164.64 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 589' ' ' THR . . . . . . . . . . . . . 70.0 p -130.3 168.48 16.82 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 125.39 1.476 . . . . 0.0 111.827 -173.387 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -124.52 137.86 54.38 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 123.93 0.892 . . . . 0.0 109.791 173.422 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.93 137.85 56.36 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 124.712 1.205 . . . . 0.0 110.549 174.871 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 592' ' ' VAL . . . . . . . . . . . . . 2.7 m . . . . . 0 N--CA 1.48 1.029 0 C-N-CA 125.623 1.569 . . . . 0.0 109.601 178.322 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo . . . . . 0 CA--C 1.541 0.847 0 CA-C-O 122.173 0.822 . . . . 0.0 113.535 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 90.6 t -131.93 136.8 56.18 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.854 0 C-N-CA 126.559 1.944 . . . . 0.0 108.431 173.629 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -62.34 139.04 96.41 Favored Pre-proline 0 CA--C 1.547 0.864 0 O-C-N 121.78 -0.575 . . . . 0.0 111.952 -177.344 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -69.04 161.36 46.15 Favored 'Trans proline' 0 CA--C 1.539 0.738 0 C-N-CA 121.976 1.784 . . . . 0.0 110.587 177.995 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 46.9 Cg_exo . . . . . 0 N--CA 1.459 -0.51 0 C-N-CA 122.227 1.952 . . . . 0.0 111.95 176.194 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 13.2 mt . . . . . 0 CA--C 1.543 0.676 0 N-CA-C 111.404 0.15 . . . . 0.0 111.404 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_endo -66.99 162.33 38.57 Favored 'Trans proline' 0 CA--C 1.538 0.718 0 C-N-CA 123.436 2.757 . . . . 0.0 114.776 -171.245 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -56.78 128.58 30.55 Favored 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 123.793 2.996 . . . . 0.0 111.077 176.536 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 73.9 2.26 61.04 Favored Glycine 0 CA--C 1.535 1.311 0 CA-C-O 116.956 -2.024 . . . . 0.0 116.384 -176.851 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 35.7 t80 -38.48 127.54 1.44 Allowed 'General case' 0 C--N 1.349 0.563 0 CA-C-N 121.053 2.427 . . . . 0.0 116.909 -175.741 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 48.8 mtm -104.25 -53.17 2.78 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 123.631 0.772 . . . . 0.0 112.116 -176.911 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 523' ' ' PHE . . . . . . . . . . . . . 25.6 p90 -166.58 172.29 10.86 Favored 'General case' 0 N--CA 1.465 0.322 0 C-N-CA 125.775 1.63 . . . . 0.0 113.181 -174.539 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 524' ' ' LYS . . . . . 0.536 ' HE2' ' CD2' ' A' ' 548' ' ' LEU . 78.3 mttt -104.52 164.8 11.49 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 121.214 -0.929 . . . . 0.0 112.446 170.369 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 14.6 m -133.85 161.92 40.22 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 126.686 1.995 . . . . 0.0 109.383 164.688 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 33.1 tt0 -125.44 130.01 50.98 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-N 118.929 0.786 . . . . 0.0 111.919 168.703 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 527' ' ' ALA . . . . . . . . . . . . . . . -62.28 127.25 30.48 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.098 0.959 . . . . 0.0 111.518 178.613 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 40.1 mm-40 -88.66 -29.05 20.21 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 125.409 1.483 . . . . 0.0 110.813 170.634 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 97.5 m-70 -137.34 157.19 47.15 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 126.13 1.772 . . . . 0.0 111.518 -176.198 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 14.8 p-10 -83.12 131.6 35.13 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 114.908 1.447 . . . . 0.0 114.908 178.085 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 78.0 t80 -133.75 116.5 15.82 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.337 1.055 . . . . 0.0 112.356 -172.335 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 2.3 m -83.77 125.61 32.09 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 114.947 1.462 . . . . 0.0 114.947 176.657 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -71.67 142.49 49.88 Favored 'General case' 0 CA--C 1.538 0.508 0 O-C-N 121.459 -0.775 . . . . 0.0 111.702 172.634 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 2.9 t -138.44 -4.59 1.64 Allowed 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 126.476 1.91 . . . . 0.0 115.78 -175.845 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 19.6 m-20 -119.53 155.04 32.92 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 127.138 2.175 . . . . 0.0 116.018 164.082 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 5.6 t -55.75 -22.63 25.05 Favored 'General case' 0 N--CA 1.477 0.911 0 N-CA-C 116.62 2.081 . . . . 0.0 116.62 -179.628 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 70.1 m-20 -99.05 -8.14 25.75 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 115.622 1.712 . . . . 0.0 115.622 177.337 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 11.8 mt-10 -74.52 157.07 36.14 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 114.89 1.441 . . . . 0.0 114.89 -177.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -103.7 137.37 41.83 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 127.807 2.443 . . . . 0.0 111.147 173.808 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 33.4 tt0 -94.12 121.73 35.92 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.955 1.302 . . . . 0.0 111.512 176.443 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 71.2 mt -118.52 148.18 42.89 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.645 1.178 . . . . 0.0 113.076 -177.429 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 5.9 tppt? -112.25 145.04 40.65 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 127.245 2.218 . . . . 0.0 110.296 166.294 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -56.46 104.04 0.13 Allowed 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.694 0.798 . . . . 0.0 110.565 172.237 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 121.18 -9.45 10.24 Favored Glycine 0 CA--C 1.535 1.305 0 C-N-CA 125.925 1.726 . . . . 0.0 114.736 -173.183 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 88.7 m-20 -70.56 124.9 25.35 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 119.854 1.827 . . . . 0.0 114.945 -178.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 2.4 t -74.65 136.54 24.95 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 CA-C-N 118.313 0.506 . . . . 0.0 111.615 165.333 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 1.2 t -128.55 121.4 55.03 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 C-N-CA 124.69 1.196 . . . . 0.0 111.703 176.523 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 548' ' ' LEU . . . . . 0.536 ' CD2' ' HE2' ' A' ' 524' ' ' LYS . 17.2 mt -77.83 100.54 6.36 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.697 1.199 . . . . 0.0 108.533 175.792 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 549' ' ' VAL . . . . . . . . . . . . . 7.2 t -61.42 130.24 25.3 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.966 0 N-CA-C 113.945 1.091 . . . . 0.0 113.945 173.118 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 8.3 pt -127.61 156.76 74.91 Favored Pre-proline 0 CA--C 1.542 0.659 0 C-N-CA 126.443 1.897 . . . . 0.0 109.564 178.102 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 80.0 Cg_endo -70.78 154.19 63.85 Favored 'Trans proline' 0 CA--C 1.538 0.715 0 C-N-CA 123.016 2.477 . . . . 0.0 111.523 171.083 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 33.1 m-85 . . . . . 0 CA--C 1.542 0.649 0 N-CA-C 115.581 1.697 . . . . 0.0 115.581 172.02 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 38.4 tt0 . . . . . 0 CA--C 1.542 0.636 0 N-CA-C 113.184 0.809 . . . . 0.0 113.184 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -114.85 137.36 52.05 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 126.657 1.983 . . . . 0.0 113.757 -176.848 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 39.8 tp10 -74.39 133.95 42.45 Favored 'General case' 0 N--CA 1.474 0.744 0 O-C-N 120.406 -1.434 . . . . 0.0 112.664 -168.847 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 84.36 -8.1 69.43 Favored Glycine 0 CA--C 1.536 1.359 0 C-N-CA 125.412 1.482 . . . . 0.0 114.264 -173.4 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 60.2 m95 -92.58 161.41 14.6 Favored 'General case' 0 C--O 1.235 0.291 0 C-N-CA 125.389 1.476 . . . . 0.0 112.642 175.547 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 13.9 mt -132.99 152.15 51.99 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 124.815 1.246 . . . . 0.0 109.603 166.267 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 39.4 tpp -106.68 140.23 39.87 Favored 'General case' 0 N--CA 1.465 0.275 0 C-N-CA 124.46 1.104 . . . . 0.0 110.389 171.732 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -165.33 -172.72 33.1 Favored Glycine 0 CA--C 1.523 0.564 0 CA-C-O 122.191 0.884 . . . . 0.0 113.395 174.376 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 12.7 p -130.15 137.92 55.22 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.383 0 C-N-CA 125.386 1.474 . . . . 0.0 108.816 169.433 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 29.4 mtmt -56.82 134.19 54.99 Favored 'General case' 0 N--CA 1.465 0.303 0 O-C-N 121.406 -0.809 . . . . 0.0 110.917 175.49 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -61.41 -38.75 88.22 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-O 118.993 -0.527 . . . . 0.0 111.042 177.686 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 10.8 t -66.07 -35.0 79.36 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 119.439 1.018 . . . . 0.0 112.246 175.5 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 -59.15 -51.11 71.44 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 114.024 1.12 . . . . 0.0 114.024 168.53 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 61.9 t-105 -69.66 -32.54 71.24 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.685 1.594 . . . . 0.0 113.286 -178.817 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 12.3 t-20 -78.95 -18.38 53.86 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 125.315 1.446 . . . . 0.0 112.607 173.949 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 8.8 mm100 -90.08 5.26 47.49 Favored 'General case' 0 CA--C 1.546 0.822 0 CA-C-N 119.333 0.969 . . . . 0.0 113.514 163.509 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 83.8 m-70 61.85 25.81 15.56 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 126.367 1.867 . . . . 0.0 114.623 172.145 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 78.4 mttt -68.24 155.29 40.0 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 125.448 1.499 . . . . 0.0 111.489 177.28 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 6.9 pm0 -64.53 104.78 0.84 Allowed 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 114.295 1.22 . . . . 0.0 114.295 -169.133 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 56.1 tp -51.91 -45.06 64.09 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.348 1.059 . . . . 0.0 113.266 -173.961 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -66.28 -19.73 65.9 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 114.334 1.235 . . . . 0.0 114.334 -174.171 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 14.6 mmmm -100.37 -41.02 7.2 Favored 'General case' 0 N--CA 1.481 1.111 0 CA-C-N 119.104 0.865 . . . . 0.0 112.208 164.465 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 91.0 m -71.59 -23.61 61.76 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 114.979 1.474 . . . . 0.0 114.979 -169.733 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 38.0 ptt180 -62.38 166.03 5.47 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 125.097 1.359 . . . . 0.0 112.293 172.03 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -176.92 169.45 41.84 Favored Glycine 0 CA--C 1.522 0.509 0 N-CA-C 114.888 0.715 . . . . 0.0 114.888 172.583 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 31.6 m -86.06 145.71 7.42 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.213 0 C-N-CA 123.817 0.847 . . . . 0.0 110.872 170.909 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 47.8 p90 -142.96 155.07 62.62 Favored Pre-proline 0 CA--C 1.545 0.752 0 C-N-CA 125.426 1.49 . . . . 0.0 112.186 174.831 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -68.19 113.61 3.13 Favored 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.361 2.04 . . . . 0.0 109.703 171.441 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 20.2 pt-20 -58.6 -26.47 63.7 Favored 'General case' 0 N--CA 1.475 0.805 0 O-C-N 121.269 -0.894 . . . . 0.0 112.497 -177.668 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 9.0 p-10 -68.77 -16.2 63.73 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 126.503 1.921 . . . . 0.0 114.435 176.73 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 19.0 m-85 -72.78 -14.1 61.46 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 116.749 2.129 . . . . 0.0 116.749 162.008 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 589' ' ' THR . . . . . . . . . . . . . 64.1 p -124.27 177.27 5.94 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 126.173 1.789 . . . . 0.0 110.957 -176.261 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 16.8 pt-20 -131.62 138.57 48.85 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.511 0.724 . . . . 0.0 110.368 170.35 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -70.85 111.75 6.51 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 125.465 1.506 . . . . 0.0 109.849 -177.511 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 592' ' ' VAL . . . . . . . . . . . . . 2.6 m . . . . . 0 N--CA 1.479 1.014 0 C-N-CA 124.78 1.232 . . . . 0.0 109.428 -178.688 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 39.0 Cg_endo . . . . . 0 CA--C 1.536 0.585 0 N-CA-C 113.651 0.597 . . . . 0.0 113.651 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 19.9 t -132.64 125.36 52.85 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 125.337 1.455 . . . . 0.0 111.445 -178.324 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -66.04 141.11 97.33 Favored Pre-proline 0 CA--C 1.547 0.853 0 C-N-CA 123.639 0.776 . . . . 0.0 113.035 -174.443 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -72.7 167.17 27.88 Favored 'Trans proline' 0 CA--C 1.547 1.149 0 C-N-CA 122.415 2.076 . . . . 0.0 112.579 175.557 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo . . . . . 0 CA--C 1.536 0.608 0 C-N-CA 123.097 2.531 . . . . 0.0 113.244 174.495 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 513' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.963 0 N-CA-C 111.521 -0.632 . . . . 0.0 111.521 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 514' ' ' ARG . . . . . . . . . . . . . 10.1 mmt180 -102.42 151.71 21.97 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 125.832 1.653 . . . . 0.0 113.805 -174.422 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 39.3 tp -115.95 -18.31 10.73 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 124.548 1.139 . . . . 0.0 113.015 176.639 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 516' ' ' ASP . . . . . . . . . . . . 0.286 6.9 p-10 -80.25 118.41 21.89 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 123.878 0.871 . . . . 0.0 113.343 152.364 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 14.1 mt -129.55 164.65 38.39 Favored Pre-proline 0 CA--C 1.543 0.703 0 C-N-CA 125.234 1.413 . . . . 0.0 112.23 -153.627 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -66.5 160.53 45.38 Favored 'Trans proline' 0 CA--C 1.537 0.631 0 C-N-CA 123.408 2.739 . . . . 0.0 113.401 -174.46 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 44.6 Cg_endo -59.05 133.15 51.43 Favored 'Trans proline' 0 N--CA 1.458 -0.564 0 C-N-CA 123.155 2.57 . . . . 0.0 110.656 -177.918 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 70.57 2.45 43.41 Favored Glycine 0 CA--C 1.537 1.451 0 CA-C-O 117.422 -1.765 . . . . 0.0 116.378 -178.803 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 19.6 t80 -34.6 131.61 0.34 Allowed 'General case' 0 CA--C 1.543 0.711 0 N-CA-C 117.76 2.504 . . . . 0.0 117.76 179.733 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 52.8 mtm -100.38 -57.02 2.21 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 -176.379 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 523' ' ' PHE . . . . . . . . . . . . . 32.7 p90 -167.58 173.7 8.38 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 127.963 2.505 . . . . 0.0 110.848 -176.093 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 524' ' ' LYS . . . . . 0.502 ' HE2' ' CD2' ' A' ' 548' ' ' LEU . 85.3 mttt -106.34 160.31 15.47 Favored 'General case' 0 N--CA 1.47 0.558 0 O-C-N 121.212 -0.93 . . . . 0.0 111.22 172.358 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 15.5 m -130.24 161.28 40.3 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 C-N-CA 126.184 1.794 . . . . 0.0 109.39 165.377 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 26.9 tt0 -127.41 128.83 46.46 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 119.541 1.064 . . . . 0.0 111.803 172.001 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 527' ' ' ALA . . . . . . . . . . . . . . . -60.99 127.98 34.2 Favored 'General case' 0 CA--C 1.538 0.494 0 O-C-N 121.188 -0.945 . . . . 0.0 111.288 179.566 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 29.3 mm-40 -94.43 -25.75 16.78 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.49 1.516 . . . . 0.0 111.237 173.261 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 77.3 m-70 -135.66 162.9 31.43 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 127.444 2.298 . . . . 0.0 109.367 -178.652 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -90.51 143.31 26.87 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 121.117 -0.989 . . . . 0.0 113.29 177.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 89.6 t80 -136.25 125.29 24.37 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.978 1.311 . . . . 0.0 114.054 -177.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 3.5 m -96.92 120.64 37.64 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 113.785 1.032 . . . . 0.0 113.785 174.107 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -65.54 116.94 7.32 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-O 121.541 0.686 . . . . 0.0 111.901 -176.952 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 13.1 t -81.46 -28.54 34.11 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 123.897 0.879 . . . . 0.0 113.27 -173.82 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -140.36 176.72 8.54 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 116.268 1.951 . . . . 0.0 116.268 -165.343 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 536' ' ' THR . . . . . . . . . . . . 0.305 0.6 OUTLIER -75.84 -5.53 46.42 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 118.86 2.911 . . . . 0.0 118.86 -162.333 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . 0.389 1.6 p-10 -110.39 -10.22 14.59 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 115.832 1.79 . . . . 0.0 115.832 165.787 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 30.4 mp0 -80.4 145.2 32.11 Favored 'General case' 0 CA--C 1.557 1.238 0 N-CA-C 114.798 1.407 . . . . 0.0 114.798 -167.777 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -97.76 138.35 35.25 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 129.303 3.041 . . . . 0.0 110.699 -177.561 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 20.4 tt0 -90.49 135.0 33.97 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 123.958 0.903 . . . . 0.0 112.354 175.032 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 80.0 mt -126.75 145.75 50.49 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 125.159 1.384 . . . . 0.0 112.469 -179.691 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 9.9 tmtt? -112.32 141.2 46.33 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 125.34 1.456 . . . . 0.0 108.803 167.362 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -52.11 109.84 0.42 Allowed 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 118.888 0.767 . . . . 0.0 110.748 174.179 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 115.9 -8.81 18.91 Favored Glycine 0 CA--C 1.535 1.295 0 C-N-CA 125.797 1.665 . . . . 0.0 114.807 -174.651 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 64.5 m-20 -72.47 121.11 19.04 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 119.959 1.88 . . . . 0.0 114.279 -179.48 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 6.5 t -71.48 135.52 27.77 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 CA-C-N 118.688 0.676 . . . . 0.0 110.404 164.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -123.53 123.77 68.11 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.489 0 C-N-CA 125.813 1.645 . . . . 0.0 110.828 174.839 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 548' ' ' LEU . . . . . 0.502 ' CD2' ' HE2' ' A' ' 524' ' ' LYS . 21.6 mt -81.11 100.63 9.14 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 108.118 -1.067 . . . . 0.0 108.118 179.148 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 549' ' ' VAL . . . . . . . . . . . . . 5.7 t -60.43 130.02 23.72 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.166 0 N-CA-C 113.811 1.041 . . . . 0.0 113.811 174.31 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 10.2 pt -127.37 157.47 72.6 Favored Pre-proline 0 CA--C 1.549 0.936 0 C-N-CA 126.77 2.028 . . . . 0.0 110.514 177.263 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_endo -74.58 151.28 41.56 Favored 'Trans proline' 0 CA--C 1.54 0.812 0 C-N-CA 123.813 3.009 . . . . 0.0 111.729 172.402 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 42.0 m-85 -69.04 155.7 39.91 Favored 'General case' 0 CA--C 1.539 0.523 0 N-CA-C 118.013 2.597 . . . . 0.0 118.013 -177.379 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 553' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 -75.67 -15.19 60.35 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 114.554 1.316 . . . . 0.0 114.554 171.413 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -159.38 152.16 18.04 Favored Pre-proline 0 CA--C 1.547 0.847 0 C-N-CA 125.861 1.664 . . . . 0.0 110.009 169.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 555' ' ' PRO . . . . . . . . . . . . . 91.7 Cg_endo -70.86 -29.52 18.53 Favored 'Trans proline' 0 CA--C 1.54 0.809 0 C-N-CA 123.736 2.957 . . . . 0.0 112.775 -179.794 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 26.4 pt-20 -70.89 -21.32 62.41 Favored 'General case' 0 CA--C 1.542 0.655 0 O-C-N 121.01 -1.056 . . . . 0.0 112.955 175.463 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 557' ' ' GLU . . . . . . . . . . . . . 40.8 mm-40 -79.6 -22.12 44.1 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.893 0.877 . . . . 0.0 113.1 179.165 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 33.9 tt0 -69.72 103.64 2.2 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-O 122.731 1.253 . . . . 0.0 111.739 171.734 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . 0.254 48.7 m-20 -71.82 139.21 48.84 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 125.587 1.555 . . . . 0.0 114.427 174.395 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -70.18 124.6 24.52 Favored 'General case' 0 CA--C 1.541 0.629 0 O-C-N 120.754 -1.216 . . . . 0.0 110.944 -174.046 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 84.79 1.08 89.11 Favored Glycine 0 CA--C 1.54 1.595 0 N-CA-C 115.089 0.796 . . . . 0.0 115.089 -171.536 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 46.4 m95 -102.34 163.76 12.05 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 125.194 1.398 . . . . 0.0 113.554 179.564 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 14.5 mt -132.89 150.59 52.15 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 125.724 1.609 . . . . 0.0 109.856 170.155 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 54.8 ttm -106.12 140.57 38.88 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 124.208 1.003 . . . . 0.0 112.03 170.017 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -166.17 -172.57 33.66 Favored Glycine 0 CA--C 1.522 0.52 0 C-N-CA 124.37 0.986 . . . . 0.0 112.797 173.748 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 14.5 p -130.35 140.99 47.44 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.551 0 C-N-CA 125.405 1.482 . . . . 0.0 108.9 169.473 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 39.8 mtmt -58.6 136.24 57.56 Favored 'General case' 0 CA--C 1.52 -0.174 0 O-C-N 121.53 -0.731 . . . . 0.0 111.44 176.489 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -60.63 -40.89 93.59 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 117.663 -1.16 . . . . 0.0 111.783 -178.74 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 57.4 m -68.84 -35.59 77.14 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 120.52 1.509 . . . . 0.0 111.878 176.649 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -58.59 -33.11 69.62 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 114.05 1.129 . . . . 0.0 114.05 171.793 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 62.9 t-105 -84.77 -34.48 22.79 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.798 1.639 . . . . 0.0 113.888 174.709 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 7.8 t-20 -71.42 -22.0 61.91 Favored 'General case' 0 CA--C 1.552 1.023 0 C-N-CA 126.671 1.989 . . . . 0.0 111.984 175.006 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 41.4 mt-30 -85.55 -5.76 59.25 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 126.266 1.826 . . . . 0.0 113.04 167.083 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 21.7 m-70 58.49 38.38 25.53 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 127.392 2.277 . . . . 0.0 113.255 172.86 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 71.9 mttt -75.14 166.06 24.25 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 126.33 1.852 . . . . 0.0 112.476 177.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 3.2 pm0 -51.25 96.73 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 126.043 1.737 . . . . 0.0 114.644 177.685 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 42.8 tp -55.7 -49.32 73.32 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 126.057 1.743 . . . . 0.0 112.448 -170.079 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 64.0 mt-10 -67.73 -13.08 61.81 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 114.521 1.304 . . . . 0.0 114.521 -176.142 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 43.7 mmtm -105.18 -25.13 12.6 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 125.569 1.548 . . . . 0.0 112.898 172.466 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 90.3 m -82.61 -28.18 30.98 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 114.117 1.154 . . . . 0.0 114.117 178.109 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 36.4 ptt180 -70.24 161.65 29.91 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 124.454 1.102 . . . . 0.0 112.917 176.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -173.91 174.79 46.41 Favored Glycine 0 N--CA 1.468 0.812 0 C-N-CA 124.651 1.12 . . . . 0.0 114.493 176.526 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 13.1 m -93.27 137.33 22.77 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 C-N-CA 125.065 1.346 . . . . 0.0 112.7 172.033 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 39.8 p90 -132.33 155.68 80.99 Favored Pre-proline 0 CA--C 1.539 0.553 0 C-N-CA 125.098 1.359 . . . . 0.0 114.004 178.004 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 62.6 Cg_endo -66.75 107.82 1.34 Allowed 'Trans proline' 0 N--CA 1.458 -0.616 0 C-N-CA 122.49 2.127 . . . . 0.0 109.87 168.813 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 17.6 pt-20 -51.8 -30.06 21.66 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 124.558 1.143 . . . . 0.0 113.11 178.912 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 11.9 p-10 -70.67 -13.99 62.29 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 126.842 2.057 . . . . 0.0 114.33 179.437 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 9.9 m-85 -76.52 -14.62 60.01 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 116.384 1.994 . . . . 0.0 116.384 165.697 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 589' ' ' THR . . . . . . . . . . . . . 71.0 p -121.07 173.22 7.41 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 125.617 1.567 . . . . 0.0 111.871 -174.333 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -125.18 140.44 52.86 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 124.175 0.99 . . . . 0.0 110.195 171.417 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 15.4 tpt180 -62.97 114.74 3.86 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 124.682 1.193 . . . . 0.0 110.014 171.122 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 592' ' ' VAL . . . . . . . . . . . . . 2.0 m -96.2 154.47 38.77 Favored Pre-proline 0 N--CA 1.476 0.861 0 C-N-CA 124.521 1.128 . . . . 0.0 108.87 177.328 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 593' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo . . . . . 0 C--O 1.252 1.203 0 C-N-CA 124.292 3.328 . . . . 0.0 113.141 -177.297 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B 1728 ' ' SER . . . . . . . . . . . . . 9.3 p . . . . . 0 N--CA 1.477 0.919 0 N-CA-C 112.839 0.681 . . . . 0.0 112.839 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B 1729 ' ' THR . . . . . . . . . . . . 0.279 31.0 p 56.66 32.87 21.85 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 126.758 2.023 . . . . 0.0 115.374 163.724 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B 1730 ' ' VAL . . . . . . . . . . . . . 1.9 m -80.27 145.27 59.71 Favored Pre-proline 0 N--CA 1.48 1.06 0 N-CA-C 114.319 1.229 . . . . 0.0 114.319 176.634 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 79.7 Cg_endo -71.28 169.56 20.43 Favored 'Trans proline' 0 CA--C 1.542 0.91 0 C-N-CA 123.363 2.709 . . . . 0.0 113.185 172.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 11.8 t -132.12 128.27 58.87 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.12 0 C-N-CA 124.904 1.281 . . . . 0.0 112.71 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -67.21 136.63 93.85 Favored Pre-proline 0 CA--C 1.549 0.94 0 O-C-N 121.389 -0.82 . . . . 0.0 112.633 -176.896 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -77.41 162.28 30.92 Favored 'Trans proline' 0 CA--C 1.548 1.183 0 C-N-CA 123.032 2.488 . . . . 0.0 113.561 -175.559 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 61.8 Cg_endo -71.61 125.93 11.63 Favored 'Trans proline' 0 CA--C 1.54 0.794 0 C-N-CA 123.447 2.765 . . . . 0.0 112.909 -178.709 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B 1736 ' ' ARG . . . . . . . . . . . . . 1.9 mpp_? -77.78 155.46 31.13 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 125.218 1.407 . . . . 0.0 111.128 172.799 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B 1737 ' ' ARG . . . . . . . . . . . . . 11.9 mmt85 -120.09 160.52 22.69 Favored 'General case' 0 N--CA 1.479 1.008 0 N-CA-C 112.912 0.708 . . . . 0.0 112.912 -165.041 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B 1738 ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -57.33 143.93 37.91 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 123.81 0.844 . . . . 0.0 112.399 178.57 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B 1739 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -153.07 154.37 34.74 Favored 'General case' 0 N--CA 1.479 1.019 0 N-CA-C 113.288 0.848 . . . . 0.0 113.288 164.018 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B 1740 ' ' GLY . . . . . . . . . . . . . . . 65.28 24.76 70.81 Favored Glycine 0 CA--C 1.537 1.463 0 C-N-CA 124.283 0.944 . . . . 0.0 115.03 179.541 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B 1741 ' ' ARG . . . . . . . . . . . . . 64.8 ttt-85 -74.03 129.98 38.94 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 124.974 1.31 . . . . 0.0 112.033 -173.505 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B 1742 ' ' ASN . . . . . . . . . . . . . 2.0 t30 -155.83 138.18 14.83 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.943 1.297 . . . . 0.0 111.9 -177.137 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B 1743 ' ' LEU . . . . . . . . . . . . . 94.8 mt -140.6 163.15 33.64 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 126.299 1.839 . . . . 0.0 110.753 176.424 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B 1744 ' ' THR . . . . . . . . . . . . 0.278 0.2 OUTLIER . . . . . 0 C--O 1.257 1.472 0 N-CA-C 117.378 2.362 . . . . 0.0 117.378 -178.745 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 513' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.773 0 N-CA-C 111.427 -0.669 . . . . 0.0 111.427 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 514' ' ' ARG . . . . . . . . . . . . . 17.7 mmt180 -138.09 153.8 49.27 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 126.66 1.984 . . . . 0.0 112.74 176.508 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 49.2 tp -120.91 -20.4 6.92 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.551 1.541 . . . . 0.0 113.255 174.079 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 516' ' ' ASP . . . . . . . . . . . . 0.322 2.3 p-10 -66.9 112.23 4.19 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 119.353 0.979 . . . . 0.0 112.475 148.866 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 12.1 mt -127.96 160.36 61.8 Favored Pre-proline 0 CA--C 1.537 0.469 0 C-N-CA 124.86 1.264 . . . . 0.0 111.213 -161.325 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -64.47 159.48 44.09 Favored 'Trans proline' 0 N--CA 1.458 -0.591 0 C-N-CA 122.986 2.457 . . . . 0.0 112.94 -174.178 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -62.5 135.58 54.06 Favored 'Trans proline' 0 N--CA 1.457 -0.662 0 C-N-CA 122.503 2.135 . . . . 0.0 109.89 177.318 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 77.57 -3.69 58.76 Favored Glycine 0 CA--C 1.531 1.06 0 CA-C-O 117.358 -1.801 . . . . 0.0 115.217 -179.762 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 32.8 t80 -34.64 125.05 0.53 Allowed 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 117.202 2.297 . . . . 0.0 117.202 -176.781 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 45.7 mtm -94.45 -51.43 4.77 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 112.241 0.46 . . . . 0.0 112.241 -178.019 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 523' ' ' PHE . . . . . . . . . . . . . 22.6 p90 -171.0 167.12 7.35 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 127.645 2.378 . . . . 0.0 112.609 -172.072 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 524' ' ' LYS . . . . . 0.438 ' HE2' ' CD2' ' A' ' 548' ' ' LEU . 72.1 mttt -96.81 160.27 14.46 Favored 'General case' 0 CA--C 1.534 0.332 0 O-C-N 121.234 -0.916 . . . . 0.0 111.027 166.699 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 32.1 m -134.56 158.49 41.77 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 C-N-CA 126.297 1.839 . . . . 0.0 108.614 166.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 40.1 tt0 -125.43 130.16 51.29 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-N 119.327 0.967 . . . . 0.0 112.343 173.989 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 527' ' ' ALA . . . . . . . . . . . . . . . -64.98 117.9 8.3 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 124.488 1.115 . . . . 0.0 111.426 -177.669 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 75.7 mm-40 -80.87 -29.13 35.8 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 123.474 0.709 . . . . 0.0 111.459 173.497 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 97.8 m-70 -136.83 160.11 39.84 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 125.894 1.678 . . . . 0.0 111.295 -177.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . 0.312 4.6 p30 -82.33 136.36 35.03 Favored 'General case' 0 CA--C 1.546 0.807 0 N-CA-C 115.651 1.723 . . . . 0.0 115.651 178.817 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 82.3 t80 -140.26 128.75 22.78 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 126.095 1.758 . . . . 0.0 112.955 -178.551 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 2.6 m -104.17 135.77 45.03 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 124.864 1.266 . . . . 0.0 113.985 175.501 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -73.23 126.77 30.85 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 112.85 0.685 . . . . 0.0 112.85 -173.452 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 2.8 p -90.96 -3.66 57.12 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 127.757 2.423 . . . . 0.0 116.051 177.669 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 24.6 t0 -148.97 159.47 44.17 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.383 1.473 . . . . 0.0 107.878 -170.225 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 2.0 t -67.24 -20.86 65.73 Favored 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 115.048 1.499 . . . . 0.0 115.048 169.448 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 13.8 t0 -82.53 -20.36 36.8 Favored 'General case' 0 CA--C 1.551 0.986 0 C-N-CA 123.349 0.66 . . . . 0.0 110.426 177.562 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 72.1 mt-10 -82.13 153.12 26.2 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 125.252 1.421 . . . . 0.0 114.744 -173.867 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -98.54 139.1 34.78 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 127.684 2.393 . . . . 0.0 110.307 176.668 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 14.3 tt0 -91.38 130.88 37.17 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.001 0.92 . . . . 0.0 111.07 172.233 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 73.4 mt -128.61 139.96 52.01 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 124.939 1.296 . . . . 0.0 112.245 -177.535 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 14.3 tmtt? -110.55 145.7 37.33 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 126.257 1.823 . . . . 0.0 109.872 171.177 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -59.21 94.24 0.02 OUTLIER 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 124.231 1.013 . . . . 0.0 112.5 177.675 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 131.45 -8.81 5.6 Favored Glycine 0 CA--C 1.532 1.099 0 C-N-CA 126.522 2.01 . . . . 0.0 114.758 -173.399 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 86.2 m-20 -70.7 122.22 19.41 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 119.766 1.783 . . . . 0.0 114.248 -178.547 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 3.4 t -72.2 135.96 26.71 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.415 0 CA-C-N 118.378 0.535 . . . . 0.0 110.546 163.281 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 1.3 t -125.1 123.78 66.1 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.453 0 C-N-CA 126.749 2.02 . . . . 0.0 110.607 177.052 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 548' ' ' LEU . . . . . 0.438 ' CD2' ' HE2' ' A' ' 524' ' ' LYS . 26.7 mt -81.38 98.69 8.32 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 108.15 -1.056 . . . . 0.0 108.15 177.752 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 549' ' ' VAL . . . . . . . . . . . . . 5.9 t -62.93 132.05 28.62 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.132 0 N-CA-C 114.315 1.228 . . . . 0.0 114.315 175.277 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 15.0 pt -126.63 154.72 75.53 Favored Pre-proline 0 CA--C 1.546 0.807 0 C-N-CA 126.502 1.921 . . . . 0.0 110.395 176.865 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 89.4 Cg_endo -75.69 142.37 25.76 Favored 'Trans proline' 0 C--O 1.241 0.645 0 C-N-CA 123.901 3.067 . . . . 0.0 111.807 177.465 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 48.4 m-85 -60.73 149.56 35.13 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 115.552 1.686 . . . . 0.0 115.552 178.757 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 553' ' ' GLN . . . . . 0.519 ' CD ' ' H ' ' A' ' 553' ' ' GLN . 0.0 OUTLIER -67.6 -29.42 68.76 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 124.993 1.317 . . . . 0.0 113.227 174.874 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 8.4 m-20 -150.54 149.81 27.11 Favored Pre-proline 0 CA--C 1.539 0.556 0 C-N-CA 125.019 1.327 . . . . 0.0 112.186 169.85 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 555' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -67.1 -37.73 17.96 Favored 'Trans proline' 0 CA--C 1.537 0.651 0 C-N-CA 123.123 2.549 . . . . 0.0 111.957 174.112 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 24.0 pt-20 -68.76 -11.72 60.65 Favored 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 114.024 1.12 . . . . 0.0 114.024 176.013 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 557' ' ' GLU . . . . . . . . . . . . . 72.3 mm-40 -90.32 -27.27 19.52 Favored 'General case' 0 CA--C 1.539 0.55 0 O-C-N 121.292 -0.88 . . . . 0.0 112.764 173.471 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 48.2 tt0 -66.7 125.25 25.22 Favored 'General case' 0 C--O 1.236 0.346 0 C-N-CA 125.055 1.342 . . . . 0.0 112.388 179.473 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 56.2 m-20 -82.67 141.81 32.18 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 125.262 1.425 . . . . 0.0 109.324 175.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 87.4 tt0 -76.94 125.94 30.15 Favored 'General case' 0 N--CA 1.471 0.59 0 O-C-N 120.633 -1.292 . . . . 0.0 110.543 -176.181 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 84.64 7.81 83.84 Favored Glycine 0 CA--C 1.537 1.466 0 CA-C-O 118.869 -0.962 . . . . 0.0 114.978 -171.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 43.3 m95 -111.7 155.97 22.62 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 125.709 1.603 . . . . 0.0 114.016 -179.6 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 12.6 mt -123.96 159.3 30.07 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.384 1.073 . . . . 0.0 110.725 172.098 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 51.9 ttm -118.32 143.25 46.75 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 125.051 1.341 . . . . 0.0 111.383 173.004 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -173.56 -167.54 33.43 Favored Glycine 0 CA--C 1.525 0.707 0 C-N-CA 124.256 0.931 . . . . 0.0 112.741 178.277 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 14.7 p -136.03 142.02 40.06 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 C-N-CA 125.378 1.471 . . . . 0.0 109.342 172.738 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 36.4 mtmt -58.1 135.09 56.96 Favored 'General case' 0 N--CA 1.468 0.475 0 O-C-N 121.338 -0.851 . . . . 0.0 110.876 174.989 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -59.41 -39.49 83.61 Favored 'General case' 0 C--O 1.221 -0.43 0 CA-C-O 117.711 -1.138 . . . . 0.0 111.349 177.35 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 7.6 t -68.14 -35.39 78.0 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 120.294 1.406 . . . . 0.0 111.239 179.396 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 83.8 m-20 -65.1 -33.48 76.13 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 115.184 1.55 . . . . 0.0 115.184 171.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 58.4 t-105 -83.72 -32.14 25.67 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 125.08 1.352 . . . . 0.0 113.235 175.505 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 18.4 t-20 -75.2 -14.02 60.5 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 127.133 2.173 . . . . 0.0 111.982 172.47 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 8.6 mm-40 -82.45 -4.78 58.02 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 126.676 1.99 . . . . 0.0 113.846 162.705 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 574' ' ' HIS . . . . . . . . . . . . 0.251 69.4 m-70 57.47 27.92 14.7 Favored 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 126.268 1.827 . . . . 0.0 114.735 -179.376 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 22.4 mtpp -72.35 161.82 30.31 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 126.322 1.849 . . . . 0.0 112.893 179.293 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -59.88 105.05 0.34 Allowed 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.184 1.394 . . . . 0.0 113.546 179.109 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 58.6 tp -56.95 -42.58 80.37 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 126.017 1.727 . . . . 0.0 112.283 -174.528 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 15.2 pm0 -55.96 -33.07 64.44 Favored 'General case' 0 CA--C 1.542 0.662 0 N-CA-C 114.545 1.313 . . . . 0.0 114.545 178.257 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 2.0 tppp? -88.98 -43.48 11.1 Favored 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 125.447 1.499 . . . . 0.0 110.786 177.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 87.2 m -74.83 -24.54 58.62 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 126.457 1.903 . . . . 0.0 115.146 -173.474 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 46.9 ptt85 -63.56 165.62 7.81 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 125.035 1.334 . . . . 0.0 113.585 177.598 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -172.6 174.9 45.76 Favored Glycine 0 CA--C 1.525 0.701 0 CA-C-N 115.031 -0.986 . . . . 0.0 114.639 165.534 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 32.7 m -91.97 144.51 9.11 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 C-N-CA 124.264 1.026 . . . . 0.0 111.085 166.221 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 38.3 p90 -138.24 154.38 73.85 Favored Pre-proline 0 CA--C 1.539 0.543 0 C-N-CA 125.02 1.328 . . . . 0.0 113.055 177.183 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 65.2 Cg_endo -66.71 108.79 1.51 Allowed 'Trans proline' 0 N--CA 1.457 -0.649 0 C-N-CA 121.786 1.657 . . . . 0.0 109.141 170.259 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -58.83 -21.57 56.92 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 124.01 0.924 . . . . 0.0 113.27 -178.717 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 10.5 p-10 -73.45 -8.19 54.85 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 125.752 1.621 . . . . 0.0 114.16 174.147 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 13.0 m-85 -82.7 -16.5 47.9 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 116.047 1.869 . . . . 0.0 116.047 168.036 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 589' ' ' THR . . . . . . . . . . . . . 17.7 p -122.13 -179.99 4.35 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.449 1.5 . . . . 0.0 108.452 -172.112 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -140.92 142.55 34.41 Favored 'General case' 0 CA--C 1.536 0.429 0 O-C-N 120.721 -1.237 . . . . 0.0 110.23 171.021 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -52.37 135.73 32.58 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 125.407 1.483 . . . . 0.0 110.811 172.968 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 592' ' ' VAL . . . . . . . . . . . . . 1.7 m -135.6 152.58 76.53 Favored Pre-proline 0 N--CA 1.475 0.816 0 C-N-CA 125.574 1.55 . . . . 0.0 109.412 175.055 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 593' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_endo . . . . . 0 C--O 1.253 1.235 0 C-N-CA 124.588 3.525 . . . . 0.0 112.956 178.833 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B 1728 ' ' SER . . . . . . . . . . . . . 32.7 p . . . . . 0 N--CA 1.474 0.744 0 CA-C-O 119.632 -0.223 . . . . 0.0 110.492 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B 1729 ' ' THR . . . . . . . . . . . . . 8.4 t -70.92 -32.53 69.48 Favored 'General case' 0 N--CA 1.485 1.314 0 N-CA-C 114.235 1.198 . . . . 0.0 114.235 177.162 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B 1730 ' ' VAL . . . . . . . . . . . . . 5.5 m -73.52 152.84 89.76 Favored Pre-proline 0 CA--C 1.542 0.667 0 C-N-CA 126.562 1.945 . . . . 0.0 113.089 179.461 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -71.03 161.73 45.08 Favored 'Trans proline' 0 CA--C 1.54 0.792 0 C-N-CA 122.738 2.292 . . . . 0.0 113.865 -176.579 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 6.8 p -135.05 126.36 46.45 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.706 0 C-N-CA 126.364 1.865 . . . . 0.0 110.387 -177.692 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -65.49 135.9 95.99 Favored Pre-proline 0 CA--C 1.546 0.801 0 O-C-N 121.172 -0.955 . . . . 0.0 111.778 -175.515 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 4.5 Cg_endo -69.07 162.81 40.19 Favored 'Trans proline' 0 CA--C 1.539 0.752 0 C-N-CA 122.292 1.995 . . . . 0.0 112.179 177.896 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -63.07 154.64 66.02 Favored 'Trans proline' 0 CA--C 1.538 0.696 0 C-N-CA 122.537 2.158 . . . . 0.0 111.842 168.345 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B 1736 ' ' ARG . . . . . . . . . . . . . 46.0 mtp180 -114.85 171.3 7.73 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 125.401 1.481 . . . . 0.0 113.062 177.877 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B 1737 ' ' ARG . . . . . . . . . . . . . 14.5 mmt180 -118.02 135.02 54.43 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 125.483 1.513 . . . . 0.0 111.529 175.434 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B 1738 ' ' ARG . . . . . . . . . . . . . 4.1 tpm_? -64.46 -41.7 96.37 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 124.361 1.065 . . . . 0.0 110.073 163.219 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B 1739 ' ' ARG . . . . . . . . . . . . . 8.5 tpp180 -151.2 142.61 23.43 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 125.966 1.707 . . . . 0.0 109.702 160.034 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B 1740 ' ' GLY . . . . . . . . . . . . . . . -62.79 157.55 38.36 Favored Glycine 0 CA--C 1.531 1.083 0 C-N-CA 124.147 0.879 . . . . 0.0 114.769 -174.5 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B 1741 ' ' ARG . . . . . . . . . . . . . 14.2 tpp180 -116.83 117.6 30.17 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 124.947 1.299 . . . . 0.0 110.425 174.74 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B 1742 ' ' ASN . . . . . . . . . . . . . 55.2 t30 -81.84 138.89 35.01 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 123.205 0.602 . . . . 0.0 110.906 171.07 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B 1743 ' ' LEU . . . . . . . . . . . . . 94.1 mt -132.32 122.93 25.87 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 124.966 1.306 . . . . 0.0 108.067 167.534 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B 1744 ' ' THR . . . . . . . . . . . . 0.33 0.6 OUTLIER . . . . . 0 C--O 1.25 1.123 0 N-CA-C 117.306 2.336 . . . . 0.0 117.306 -168.12 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 513' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.241 0 N-CA-C 110.881 -0.888 . . . . 0.0 110.881 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 514' ' ' ARG . . . . . . . . . . . . . 5.3 mmm180 -130.5 146.77 52.1 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 126.552 1.941 . . . . 0.0 112.814 178.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 39.9 tp -74.02 -20.15 60.41 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 125.629 1.571 . . . . 0.0 114.385 -179.012 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 516' ' ' ASP . . . . . . . . . . . . . 21.6 t0 -112.56 145.91 39.48 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 124.841 1.257 . . . . 0.0 112.202 174.83 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 11.0 mt -121.56 161.38 41.85 Favored Pre-proline 0 CA--C 1.542 0.652 0 C-N-CA 126.123 1.769 . . . . 0.0 111.517 -176.172 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_endo -68.06 159.36 53.39 Favored 'Trans proline' 0 CA--C 1.54 0.796 0 C-N-CA 123.458 2.772 . . . . 0.0 113.709 -173.768 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -62.92 126.78 18.78 Favored 'Trans proline' 0 C--N 1.347 0.492 0 C-N-CA 123.763 2.976 . . . . 0.0 111.182 -178.44 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 78.72 1.19 83.02 Favored Glycine 0 CA--C 1.533 1.172 0 CA-C-O 117.385 -1.786 . . . . 0.0 115.653 -177.265 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 27.1 t80 -34.84 137.22 0.13 Allowed 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 117.192 2.293 . . . . 0.0 117.192 179.222 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 39.6 mtm -106.29 -61.85 1.46 Allowed 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 123.891 0.876 . . . . 0.0 111.928 -178.073 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 523' ' ' PHE . . . . . . . . . . . . . 23.9 p90 -161.06 170.17 21.02 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 127.28 2.232 . . . . 0.0 112.082 -172.724 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 524' ' ' LYS . . . . . 0.441 ' HE2' ' CD2' ' A' ' 548' ' ' LEU . 71.9 mttt -104.9 163.83 12.24 Favored 'General case' 0 N--CA 1.467 0.399 0 O-C-N 121.148 -0.97 . . . . 0.0 111.288 170.358 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 8.3 m -132.4 156.53 42.5 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.881 0 C-N-CA 126.299 1.84 . . . . 0.0 109.651 165.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 44.2 tt0 -118.38 129.87 55.67 Favored 'General case' 0 N--CA 1.477 0.877 0 CA-C-N 119.795 1.18 . . . . 0.0 111.913 169.394 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 527' ' ' ALA . . . . . . . . . . . . . . . -62.11 121.8 13.96 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.155 0.982 . . . . 0.0 111.786 177.766 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 71.7 mm-40 -89.49 -18.15 27.26 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 125.957 1.703 . . . . 0.0 111.978 172.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 98.7 m-70 -144.93 161.5 39.2 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 127.577 2.351 . . . . 0.0 109.759 -175.443 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -89.5 133.06 34.74 Favored 'General case' 0 C--O 1.237 0.429 0 N-CA-C 107.079 -1.452 . . . . 0.0 107.079 -179.524 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 88.2 t80 -122.61 106.19 10.76 Favored 'General case' 0 C--O 1.235 0.306 0 C-N-CA 124.772 1.229 . . . . 0.0 113.232 177.59 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -80.6 113.84 19.07 Favored 'General case' 0 N--CA 1.469 0.503 0 N-CA-C 113.251 0.834 . . . . 0.0 113.251 170.071 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -71.47 141.63 50.21 Favored 'General case' 0 C--O 1.238 0.485 0 C-N-CA 125.244 1.418 . . . . 0.0 111.881 179.747 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 5.7 t -110.65 -37.01 5.57 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 126.178 1.791 . . . . 0.0 113.455 177.92 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 84.8 m-20 -95.11 152.48 18.31 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 116.968 2.21 . . . . 0.0 116.968 -177.547 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 4.2 t -57.12 -26.89 61.24 Favored 'General case' 0 N--CA 1.481 1.084 0 N-CA-C 116.138 1.903 . . . . 0.0 116.138 179.812 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 537' ' ' ASP . . . . . 0.459 ' CG ' HH22 ' B' 1736 ' ' ARG . 8.2 p30 -92.61 -9.37 41.27 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 116.788 2.144 . . . . 0.0 116.788 174.742 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 86.3 mt-10 -75.69 152.11 37.58 Favored 'General case' 0 CA--C 1.537 0.457 0 O-C-N 120.96 -1.088 . . . . 0.0 113.913 -177.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -97.97 132.48 43.5 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 127.561 2.344 . . . . 0.0 109.521 171.577 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 30.0 tt0 -90.03 134.45 34.23 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.037 0.935 . . . . 0.0 111.519 174.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 83.1 mt -127.63 155.36 44.0 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 125.007 1.323 . . . . 0.0 112.819 -178.196 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -129.12 142.31 50.92 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 125.556 1.542 . . . . 0.0 109.728 174.029 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -54.8 105.89 0.18 Allowed 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.34 1.056 . . . . 0.0 112.04 -175.616 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 125.43 -15.01 7.24 Favored Glycine 0 CA--C 1.531 1.061 0 C-N-CA 126.684 2.087 . . . . 0.0 113.814 -176.627 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 84.9 m-20 -73.83 119.64 18.33 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 114.909 1.448 . . . . 0.0 114.909 -171.164 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 21.8 t -70.14 137.78 23.34 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 O-C-N 122.057 -0.402 . . . . 0.0 110.83 169.178 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 1.1 t -125.84 127.55 71.36 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 C-N-CA 126.538 1.935 . . . . 0.0 111.399 174.957 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 548' ' ' LEU . . . . . 0.441 ' CD2' ' HE2' ' A' ' 524' ' ' LYS . 20.4 mt -83.76 101.7 11.78 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.356 1.063 . . . . 0.0 108.742 177.495 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 549' ' ' VAL . . . . . . . . . . . . . 6.3 t -63.88 131.12 29.43 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 N-CA-C 113.986 1.106 . . . . 0.0 113.986 174.436 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 24.6 pt -127.11 157.25 72.79 Favored Pre-proline 0 CA--C 1.548 0.87 0 C-N-CA 126.426 1.89 . . . . 0.0 110.276 177.606 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -70.93 156.43 60.3 Favored 'Trans proline' 0 CA--C 1.534 0.519 0 C-N-CA 123.779 2.986 . . . . 0.0 111.54 174.498 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 54.9 m-85 -72.19 151.22 43.08 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 115.72 1.748 . . . . 0.0 115.72 175.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 553' ' ' GLN . . . . . . . . . . . . . 6.2 pt20 -63.39 -29.51 70.8 Favored 'General case' 0 CA--C 1.544 0.712 0 O-C-N 121.487 -0.758 . . . . 0.0 112.659 169.397 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 3.8 m-20 -156.22 153.19 24.83 Favored Pre-proline 0 CA--C 1.545 0.781 0 C-N-CA 125.332 1.453 . . . . 0.0 111.95 -175.645 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 555' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_endo -70.41 -29.61 20.49 Favored 'Trans proline' 0 CA--C 1.539 0.726 0 C-N-CA 123.813 3.009 . . . . 0.0 112.712 -178.601 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 23.7 pt-20 -73.66 -14.8 61.22 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 124.862 1.265 . . . . 0.0 112.736 176.672 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 557' ' ' GLU . . . . . . . . . . . . . 73.7 mm-40 -84.64 -20.9 30.59 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 123.991 0.916 . . . . 0.0 113.206 -178.106 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 4.1 tp60 -75.15 147.06 40.81 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 125.505 1.522 . . . . 0.0 113.178 176.076 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 13.0 m-20 -120.3 156.29 31.56 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 128.173 2.589 . . . . 0.0 116.125 178.66 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -71.31 110.86 6.21 Favored 'General case' 0 N--CA 1.473 0.716 0 O-C-N 120.345 -1.472 . . . . 0.0 114.093 -165.783 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 82.69 7.63 87.13 Favored Glycine 0 CA--C 1.539 1.545 0 O-C-N 121.117 -0.989 . . . . 0.0 114.605 -175.415 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 47.6 m95 -89.64 165.96 13.91 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 126.013 1.725 . . . . 0.0 113.456 176.407 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 18.9 mt -138.48 158.05 45.0 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 126.003 1.721 . . . . 0.0 110.317 170.4 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 47.8 ttm -115.32 142.78 46.23 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 125.058 1.343 . . . . 0.0 112.078 174.011 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -171.8 -174.8 39.61 Favored Glycine 0 CA--C 1.527 0.812 0 C-N-CA 123.771 0.701 . . . . 0.0 113.328 178.056 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 12.1 p -128.11 141.23 47.02 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.829 0 C-N-CA 125.742 1.617 . . . . 0.0 109.15 171.384 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 31.8 mtmt -57.72 136.56 56.89 Favored 'General case' 0 N--CA 1.467 0.411 0 O-C-N 121.328 -0.858 . . . . 0.0 111.563 175.519 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 15.9 tt0 -58.06 -43.58 86.99 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 118.555 -0.736 . . . . 0.0 110.909 176.809 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 38.5 t -65.68 -36.25 83.1 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-N 118.932 0.787 . . . . 0.0 112.583 178.172 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 79.4 m-20 -65.3 -42.53 92.97 Favored 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 114.828 1.418 . . . . 0.0 114.828 173.515 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 72.9 t-105 -69.04 -35.55 76.72 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.564 1.146 . . . . 0.0 112.92 173.914 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 50.9 t-20 -69.06 -31.35 70.05 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 127.429 2.292 . . . . 0.0 111.737 173.891 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 12.5 mm-40 -82.45 0.74 40.84 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.966 1.306 . . . . 0.0 114.149 172.373 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 83.6 m-70 57.26 38.31 28.63 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 126.753 2.021 . . . . 0.0 113.706 178.268 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 22.3 mtpp -86.31 159.05 19.53 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 125.595 1.558 . . . . 0.0 111.043 179.881 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 12.6 pm0 -56.49 98.71 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 115.029 1.492 . . . . 0.0 115.029 -167.179 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 44.6 tp -50.64 -47.18 58.53 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 125.042 1.337 . . . . 0.0 112.665 -173.229 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 72.4 mm-40 -66.27 -12.64 57.62 Favored 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 114.371 1.248 . . . . 0.0 114.371 -174.124 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 13.1 tptp -117.83 -33.16 4.59 Favored 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 125.501 1.521 . . . . 0.0 113.173 177.684 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 71.1 m -65.22 -31.83 73.19 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 125.635 1.574 . . . . 0.0 112.504 173.119 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 29.6 ptt85 -60.1 157.07 13.73 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 123.737 0.815 . . . . 0.0 112.668 172.215 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -171.96 173.91 45.21 Favored Glycine 0 CA--C 1.524 0.62 0 C-N-CA 123.991 0.805 . . . . 0.0 113.205 173.707 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 35.1 m -91.37 141.43 14.47 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.428 0 C-N-CA 124.008 0.923 . . . . 0.0 110.982 169.356 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 50.5 p90 -137.74 154.6 74.89 Favored Pre-proline 0 CA--C 1.538 0.498 0 C-N-CA 123.959 0.903 . . . . 0.0 113.125 175.838 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_endo -70.37 110.07 2.59 Favored 'Trans proline' 0 N--CA 1.458 -0.613 0 C-N-CA 122.207 1.938 . . . . 0.0 110.034 172.11 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 20.8 pt-20 -55.83 -26.53 47.08 Favored 'General case' 0 N--CA 1.474 0.756 0 O-C-N 121.308 -0.87 . . . . 0.0 112.675 -178.805 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 6.6 p-10 -65.35 -15.36 62.48 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 126.131 1.772 . . . . 0.0 114.48 178.199 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 27.5 m-85 -77.48 -10.99 59.79 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 116.582 2.068 . . . . 0.0 116.582 165.537 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 589' ' ' THR . . . . . . . . . . . . . 80.6 p -131.27 169.78 15.5 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 126.131 1.772 . . . . 0.0 111.734 -171.806 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -125.23 142.45 51.49 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 123.987 0.915 . . . . 0.0 110.228 172.23 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.55 134.5 56.18 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 125.252 1.421 . . . . 0.0 110.999 172.009 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 592' ' ' VAL . . . . . . . . . . . . . 5.4 m -126.67 151.53 73.42 Favored Pre-proline 0 CA--C 1.553 1.06 0 C-N-CA 124.785 1.234 . . . . 0.0 111.584 -178.546 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 593' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo . . . . . 0 C--O 1.252 1.209 1 C-N-CA 125.707 4.272 . . . . 0.0 117.182 -168.451 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B 1728 ' ' SER . . . . . . . . . . . . . 12.2 t . . . . . 0 N--CA 1.473 0.712 0 CA-C-O 120.597 0.237 . . . . 0.0 110.553 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B 1729 ' ' THR . . . . . . . . . . . . 0.387 0.2 OUTLIER 62.12 27.01 16.28 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 116.92 2.193 . . . . 0.0 116.92 176.044 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B 1730 ' ' VAL . . . . . . . . . . . . 0.292 1.1 m -111.84 142.55 26.9 Favored Pre-proline 0 N--CA 1.479 1.023 0 C-N-CA 125.139 1.375 . . . . 0.0 114.482 174.588 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 49.8 Cg_endo -69.58 178.17 4.72 Favored 'Trans proline' 0 CA--C 1.547 1.125 0 C-N-CA 124.77 3.646 . . . . 0.0 115.25 -176.675 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 60.3 t -132.65 129.87 58.93 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.068 0 C-N-CA 125.9 1.68 . . . . 0.0 110.73 178.572 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -65.08 131.41 95.15 Favored Pre-proline 0 CA--C 1.556 1.185 0 O-C-N 121.481 -0.762 . . . . 0.0 112.924 -177.348 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 50.4 Cg_endo -74.06 157.3 46.83 Favored 'Trans proline' 0 CA--C 1.541 0.842 0 C-N-CA 123.105 2.537 . . . . 0.0 114.111 -170.15 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -65.71 117.25 4.46 Favored 'Trans proline' 0 CA--C 1.535 0.56 0 C-N-CA 123.808 3.005 . . . . 0.0 112.802 -172.291 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B 1736 ' ' ARG . . . . . 0.459 HH22 ' CG ' ' A' ' 537' ' ' ASP . 83.2 mtp180 -78.47 149.5 33.19 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 125.346 1.458 . . . . 0.0 111.204 176.07 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B 1737 ' ' ARG . . . . . . . . . . . . . 12.9 mtp180 -87.81 -176.82 5.64 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 126.525 1.93 . . . . 0.0 112.027 -173.043 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B 1738 ' ' ARG . . . . . . . . . . . . . 66.1 mtt-85 -84.85 136.07 33.81 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 123.511 0.724 . . . . 0.0 110.041 158.745 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B 1739 ' ' ARG . . . . . . . . . . . . . 15.0 mtt85 -69.22 -28.57 66.48 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 126.336 1.854 . . . . 0.0 113.914 173.342 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B 1740 ' ' GLY . . . . . . . . . . . . . . . 179.24 -176.04 47.56 Favored Glycine 0 CA--C 1.531 1.069 0 N-CA-C 114.388 0.515 . . . . 0.0 114.388 -176.346 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B 1741 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.36 142.77 58.27 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.16 0.984 . . . . 0.0 111.407 175.246 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B 1742 ' ' ASN . . . . . . . . . . . . . 75.7 m-20 -77.09 89.97 3.61 Favored 'General case' 0 C--O 1.238 0.472 0 C-N-CA 124.455 1.102 . . . . 0.0 110.741 175.883 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B 1743 ' ' LEU . . . . . . . . . . . . . 51.4 tp -158.65 124.92 4.6 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 127.248 2.219 . . . . 0.0 109.03 -178.477 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B 1744 ' ' THR . . . . . . . . . . . . . 2.2 t . . . . . 0 C--O 1.25 1.087 0 C-N-CA 124.95 1.3 . . . . 0.0 114.224 -179.584 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 513' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.804 0 N-CA-C 110.32 -1.112 . . . . 0.0 110.32 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 514' ' ' ARG . . . . . . . . . . . . . 2.4 mmp_? -121.47 152.97 38.53 Favored 'General case' 0 N--CA 1.48 1.047 0 N-CA-C 114.839 1.422 . . . . 0.0 114.839 178.477 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 5.9 mp -86.13 -3.66 59.0 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 124.962 1.305 . . . . 0.0 112.756 174.149 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 516' ' ' ASP . . . . . . . . . . . . . 32.5 p-10 -134.75 133.57 40.05 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 126.538 1.935 . . . . 0.0 114.873 178.284 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 10.6 mt -121.96 160.88 45.25 Favored Pre-proline 0 CA--C 1.552 1.042 0 N-CA-C 114.61 1.337 . . . . 0.0 114.61 -164.172 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -71.0 161.14 47.12 Favored 'Trans proline' 0 CA--C 1.541 0.867 0 C-N-CA 124.655 3.57 . . . . 0.0 113.981 -172.205 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -68.19 123.95 11.19 Favored 'Trans proline' 0 C--O 1.239 0.542 0 C-N-CA 123.481 2.787 . . . . 0.0 111.818 -173.488 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 82.15 1.53 90.37 Favored Glycine 0 CA--C 1.537 1.415 0 CA-C-O 117.757 -1.579 . . . . 0.0 115.808 -175.454 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 30.6 t80 -34.18 132.02 0.28 Allowed 'General case' 0 CA--C 1.546 0.808 0 N-CA-C 118.435 2.754 . . . . 0.0 118.435 -178.53 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 31.7 mtm -101.59 -53.93 2.87 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 113.479 0.918 . . . . 0.0 113.479 -176.732 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 523' ' ' PHE . . . . . . . . . . . . . 19.3 p90 -170.02 171.09 7.21 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 126.508 1.923 . . . . 0.0 111.893 -173.299 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 524' ' ' LYS . . . . . 0.504 ' HE2' ' CD2' ' A' ' 548' ' ' LEU . 76.5 mttt -104.61 163.21 12.64 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-O 122.228 1.013 . . . . 0.0 111.684 167.904 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 12.3 m -134.34 162.44 39.01 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 126.552 1.941 . . . . 0.0 109.55 165.317 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 52.5 tt0 -127.28 129.8 48.38 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 119.035 0.834 . . . . 0.0 112.137 171.136 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 527' ' ' ALA . . . . . . . . . . . . . . . -62.84 129.62 41.27 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.119 0.967 . . . . 0.0 111.302 -178.644 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 62.6 mm-40 -98.08 -12.8 21.46 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 124.915 1.286 . . . . 0.0 112.708 173.461 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 89.0 m-70 -146.74 160.14 42.6 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 128.064 2.545 . . . . 0.0 109.243 -179.87 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 21.4 p-10 -78.53 146.14 34.47 Favored 'General case' 0 N--CA 1.466 0.375 0 O-C-N 121.432 -0.792 . . . . 0.0 111.853 170.061 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 79.3 t80 -139.72 118.27 12.24 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 124.999 1.32 . . . . 0.0 110.846 175.71 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 2.2 m -91.57 132.14 36.51 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 124.909 1.284 . . . . 0.0 113.883 173.546 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -71.19 120.83 17.33 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 123.584 0.754 . . . . 0.0 112.321 -171.208 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 2.4 p -89.23 -5.53 57.58 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 126.216 1.807 . . . . 0.0 115.763 177.595 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 8.6 t0 -147.21 158.79 44.08 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.266 1.026 . . . . 0.0 108.905 178.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 6.3 t -59.79 -23.08 62.99 Favored 'General case' 0 N--CA 1.477 0.914 0 N-CA-C 115.061 1.504 . . . . 0.0 115.061 169.567 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 23.3 t0 -75.62 -33.75 60.54 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 124.512 1.125 . . . . 0.0 110.686 174.771 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 83.6 mt-10 -73.57 147.22 44.11 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.011 1.325 . . . . 0.0 113.345 -171.071 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -92.52 138.16 31.75 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 127.275 2.23 . . . . 0.0 109.825 175.123 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 14.0 tt0 -94.07 119.54 33.07 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 123.956 0.902 . . . . 0.0 111.316 175.492 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 59.5 mt -111.59 142.17 44.23 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 124.447 1.099 . . . . 0.0 111.76 179.272 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 16.0 tptp -106.18 142.19 36.29 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 124.737 1.215 . . . . 0.0 109.816 162.498 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -47.49 121.55 4.03 Favored 'General case' 0 CA--C 1.544 0.726 0 CA-C-O 121.657 0.742 . . . . 0.0 110.881 173.66 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 98.05 -3.81 60.51 Favored Glycine 0 CA--C 1.53 0.998 0 C-N-CA 125.191 1.377 . . . . 0.0 114.127 -178.715 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 82.0 m-20 -67.5 122.11 17.27 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 118.798 1.299 . . . . 0.0 114.228 174.854 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 2.3 t -74.89 135.19 27.84 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 CA-C-N 118.554 0.615 . . . . 0.0 111.552 165.889 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -125.31 121.5 60.69 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 C-N-CA 125.443 1.497 . . . . 0.0 111.744 177.494 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 548' ' ' LEU . . . . . 0.504 ' CD2' ' HE2' ' A' ' 524' ' ' LYS . 17.8 mt -77.13 99.28 5.33 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.609 1.164 . . . . 0.0 108.595 175.241 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 549' ' ' VAL . . . . . . . . . . . . . 2.8 t -60.58 128.48 21.79 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.955 0 N-CA-C 114.011 1.115 . . . . 0.0 114.011 171.142 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 8.7 pt -123.82 154.06 67.22 Favored Pre-proline 0 CA--C 1.547 0.852 0 C-N-CA 126.438 1.895 . . . . 0.0 109.749 177.485 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -70.6 148.9 60.66 Favored 'Trans proline' 0 N--CA 1.461 -0.429 0 C-N-CA 123.653 2.902 . . . . 0.0 110.129 173.862 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 46.7 m-85 -69.32 140.97 54.37 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 114.386 1.254 . . . . 0.0 114.386 176.075 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 553' ' ' GLN . . . . . 0.478 ' CD ' ' H ' ' A' ' 553' ' ' GLN . 0.0 OUTLIER -67.24 -20.33 65.66 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 128.146 2.578 . . . . 0.0 115.225 170.934 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 37.8 m-20 -151.39 154.34 33.49 Favored Pre-proline 0 CA--C 1.549 0.94 0 C-N-CA 125.524 1.529 . . . . 0.0 112.899 -175.426 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 555' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -73.71 -39.6 1.82 Allowed 'Trans proline' 0 CA--C 1.538 0.724 0 C-N-CA 123.712 2.941 . . . . 0.0 113.214 -179.746 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 26.0 pt-20 -82.49 -16.73 47.71 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.311 1.044 . . . . 0.0 113.761 -177.735 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 557' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -69.42 -24.74 63.88 Favored 'General case' 0 CA--C 1.543 0.689 0 O-C-N 121.474 -0.766 . . . . 0.0 112.031 168.878 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 50.6 tt0 -80.29 120.4 24.31 Favored 'General case' 0 C--O 1.234 0.25 0 C-N-CA 124.348 1.059 . . . . 0.0 112.722 -176.856 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 68.9 m-20 -94.24 151.82 19.16 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 125.328 1.451 . . . . 0.0 114.109 177.775 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 80.7 tt0 -82.28 119.16 23.75 Favored 'General case' 0 CA--C 1.541 0.597 0 O-C-N 121.053 -1.029 . . . . 0.0 111.907 -167.866 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 81.94 1.58 90.31 Favored Glycine 0 CA--C 1.543 1.797 0 C-N-CA 124.327 0.965 . . . . 0.0 114.834 -171.352 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 47.5 m95 -94.38 167.01 11.79 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 126.78 2.032 . . . . 0.0 113.253 176.45 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 22.7 mt -139.56 159.7 41.55 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 125.192 1.397 . . . . 0.0 110.887 169.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 46.0 ttm -115.17 143.84 44.6 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 125.501 1.52 . . . . 0.0 112.712 176.238 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -167.34 -173.44 35.53 Favored Glycine 0 CA--C 1.525 0.705 0 C-N-CA 124.057 0.837 . . . . 0.0 113.374 175.063 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 14.3 p -129.84 142.03 44.9 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 C-N-CA 125.836 1.655 . . . . 0.0 109.477 170.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 34.0 mtmt -59.04 132.61 54.56 Favored 'General case' 0 N--CA 1.467 0.421 0 O-C-N 121.428 -0.795 . . . . 0.0 111.929 176.189 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 18.3 tt0 -59.42 -42.61 92.23 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 118.473 -0.775 . . . . 0.0 111.124 178.758 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 34.0 t -65.31 -30.79 71.68 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 119.254 0.934 . . . . 0.0 111.963 178.699 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -70.6 -40.77 73.02 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 115.086 1.513 . . . . 0.0 115.086 173.1 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 64.3 t-105 -71.06 -30.42 66.56 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.217 1.407 . . . . 0.0 112.992 172.116 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 10.1 t-20 -67.52 -34.03 76.28 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 126.472 1.909 . . . . 0.0 111.585 172.161 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 35.4 mt-30 -80.77 -0.07 36.98 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 124.886 1.275 . . . . 0.0 113.44 168.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 9.0 m-70 53.78 37.43 26.31 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 126.061 1.744 . . . . 0.0 112.943 179.444 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 6.0 mtpm? -73.17 156.46 38.59 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 125.05 1.34 . . . . 0.0 110.854 175.882 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 12.1 pm0 -57.35 105.79 0.27 Allowed 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 125.038 1.335 . . . . 0.0 114.159 -167.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 55.2 tp -55.25 -48.15 74.39 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 124.505 1.122 . . . . 0.0 112.814 -170.139 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 1.2 pp20? -66.29 -16.45 64.05 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 125.253 1.421 . . . . 0.0 114.651 -175.401 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 32.3 mmtm -106.74 -37.51 6.38 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.681 1.193 . . . . 0.0 112.671 173.213 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 91.2 m -68.47 -28.57 67.15 Favored 'General case' 0 CA--C 1.537 0.479 0 N-CA-C 112.93 0.715 . . . . 0.0 112.93 -179.816 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 38.4 ptt85 -64.29 156.99 27.24 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 113.223 0.823 . . . . 0.0 113.223 176.757 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -169.85 171.04 43.18 Favored Glycine 0 N--CA 1.466 0.697 0 CA-C-N 115.765 -0.652 . . . . 0.0 114.52 176.354 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 17.4 m -90.44 137.16 22.17 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 C-N-CA 124.753 1.221 . . . . 0.0 112.236 172.403 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 48.0 p90 -135.15 155.29 79.07 Favored Pre-proline 0 C--O 1.241 0.629 0 C-N-CA 124.502 1.121 . . . . 0.0 112.932 176.832 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_endo -69.83 109.2 2.27 Favored 'Trans proline' 0 N--CA 1.455 -0.785 0 C-N-CA 121.773 1.649 . . . . 0.0 109.359 169.84 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 20.3 pt-20 -54.41 -23.5 16.08 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 124.16 0.984 . . . . 0.0 113.578 -179.805 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 9.7 p-10 -77.84 -11.29 59.87 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 127.151 2.181 . . . . 0.0 114.755 177.858 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 11.6 m-85 -75.67 -15.76 60.28 Favored 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 116.733 2.123 . . . . 0.0 116.733 162.294 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 589' ' ' THR . . . . . . . . . . . . . 40.8 p -120.16 174.34 6.56 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 125.495 1.518 . . . . 0.0 109.479 -174.596 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -122.34 139.33 53.95 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 123.871 0.869 . . . . 0.0 109.313 172.192 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.03 116.09 8.28 Favored 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 108.088 -1.079 . . . . 0.0 108.088 176.667 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 592' ' ' VAL . . . . . . . . . . . . . 4.6 m -96.43 151.92 38.35 Favored Pre-proline 0 N--CA 1.474 0.757 0 C-N-CA 124.623 1.169 . . . . 0.0 108.062 175.743 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 593' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo . . . . . 0 C--O 1.254 1.307 0 C-N-CA 124.026 3.151 . . . . 0.0 116.769 -159.067 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B 1728 ' ' SER . . . . . . . . . . . . . 46.8 t . . . . . 0 N--CA 1.473 0.71 0 N-CA-C 112.833 0.679 . . . . 0.0 112.833 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B 1729 ' ' THR . . . . . . . . . . . . . 1.4 t -70.52 -34.0 71.82 Favored 'General case' 0 N--CA 1.477 0.925 0 N-CA-C 117.476 2.399 . . . . 0.0 117.476 -176.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B 1730 ' ' VAL . . . . . . . . . . . . . 2.2 m -79.39 149.59 72.42 Favored Pre-proline 0 N--CA 1.477 0.888 0 C-N-CA 124.601 1.16 . . . . 0.0 112.86 177.654 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -61.92 161.97 23.85 Favored 'Trans proline' 0 CA--C 1.536 0.615 0 C-N-CA 123.409 2.739 . . . . 0.0 112.397 176.026 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 5.9 t -125.57 129.64 72.75 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.858 0 C-N-CA 124.777 1.231 . . . . 0.0 112.41 -176.624 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -69.34 141.52 91.24 Favored Pre-proline 0 CA--C 1.548 0.896 0 O-C-N 121.818 -0.551 . . . . 0.0 112.163 -177.112 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 3.6 Cg_endo -66.1 162.32 36.12 Favored 'Trans proline' 0 CA--C 1.541 0.864 0 C-N-CA 122.541 2.161 . . . . 0.0 112.596 172.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -53.99 162.15 4.23 Favored 'Trans proline' 0 CA--C 1.54 0.788 0 C-N-CA 123.195 2.597 . . . . 0.0 112.809 163.435 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B 1736 ' ' ARG . . . . . . . . . . . . . 27.7 mtp-105 -124.22 138.96 54.34 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 125.577 1.551 . . . . 0.0 111.183 174.121 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B 1737 ' ' ARG . . . . . . . . . . . . . 11.3 mmm-85 -72.94 -31.23 64.46 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 126.152 1.781 . . . . 0.0 110.071 176.506 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B 1738 ' ' ARG . . . . . . . . . . . . . 60.8 ttt180 49.18 81.68 0.05 Allowed 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 127.957 2.503 . . . . 0.0 113.568 163.122 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B 1739 ' ' ARG . . . . . . . . . . . . . 6.5 ppt_? -67.43 153.47 43.61 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 124.518 1.127 . . . . 0.0 112.692 178.081 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B 1740 ' ' GLY . . . . . . . . . . . . . . . -172.76 -139.15 2.76 Favored Glycine 0 CA--C 1.531 1.034 0 N-CA-C 115.114 0.806 . . . . 0.0 115.114 177.316 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B 1741 ' ' ARG . . . . . . . . . . . . . 31.8 tpt180 -63.71 130.76 45.54 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 127.083 2.153 . . . . 0.0 113.251 -173.604 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B 1742 ' ' ASN . . . . . . . . . . . . . 84.7 m-20 49.31 39.36 15.84 Favored 'General case' 0 CA--C 1.552 1.022 0 C-N-CA 125.719 1.608 . . . . 0.0 115.154 175.006 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B 1743 ' ' LEU . . . . . . . . . . . . . 64.6 tp -70.86 -25.81 62.98 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.384 1.074 . . . . 0.0 113.144 -179.503 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B 1744 ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.253 1.253 0 N-CA-C 117.583 2.438 . . . . 0.0 117.583 179.666 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 513' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 1.094 0 N-CA-C 110.44 -1.064 . . . . 0.0 110.44 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 514' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -66.11 140.05 58.2 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.341 0.656 . . . . 0.0 111.276 -176.613 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 12.6 tp -73.6 -42.95 60.85 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.498 179.438 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 516' ' ' ASP . . . . . . . . . . . . 0.305 5.3 p-10 -84.28 140.05 31.91 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 116.774 2.139 . . . . 0.0 116.774 175.529 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 13.8 mt -129.48 158.69 72.53 Favored Pre-proline 0 CA--C 1.546 0.797 0 C-N-CA 125.813 1.645 . . . . 0.0 111.88 -165.512 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_endo -66.97 159.55 51.39 Favored 'Trans proline' 0 CA--C 1.544 0.99 0 C-N-CA 124.242 3.295 . . . . 0.0 113.932 -172.725 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_endo -61.13 121.72 10.08 Favored 'Trans proline' 0 CA--C 1.536 0.594 0 C-N-CA 123.707 2.938 . . . . 0.0 112.121 -173.298 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 77.54 4.22 84.31 Favored Glycine 0 CA--C 1.536 1.348 0 CA-C-O 117.081 -1.955 . . . . 0.0 116.27 -178.674 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 15.4 t80 -28.17 130.94 0.05 Allowed 'General case' 0 CA--C 1.547 0.851 0 N-CA-C 118.434 2.753 . . . . 0.0 118.434 178.008 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 48.5 mtm -99.41 -53.85 3.11 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 113.283 0.845 . . . . 0.0 113.283 -177.178 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 523' ' ' PHE . . . . . . . . . . . . . 17.8 p90 -166.52 165.96 16.54 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 126.439 1.896 . . . . 0.0 112.942 -172.683 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 524' ' ' LYS . . . . . 0.531 ' HE2' ' CD2' ' A' ' 548' ' ' LEU . 74.0 mttt -98.39 162.48 13.14 Favored 'General case' 0 CA--C 1.539 0.522 0 O-C-N 121.194 -0.942 . . . . 0.0 111.545 165.813 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 19.8 m -135.6 159.54 40.01 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 C-N-CA 126.546 1.938 . . . . 0.0 109.259 167.12 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 30.5 tt0 -122.04 126.86 49.43 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 124.052 0.941 . . . . 0.0 111.441 174.633 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 527' ' ' ALA . . . . . . . . . . . . . . . -61.51 124.28 20.2 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 123.975 0.91 . . . . 0.0 111.629 179.253 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 38.8 mm-40 -87.38 -18.98 28.8 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 125.825 1.65 . . . . 0.0 112.232 176.751 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 97.0 m-70 -148.37 169.12 20.87 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 128.468 2.707 . . . . 0.0 109.84 -177.507 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -83.16 144.55 29.75 Favored 'General case' 0 CA--C 1.539 0.528 0 O-C-N 121.117 -0.989 . . . . 0.0 108.937 172.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 84.3 t80 -134.63 117.25 15.9 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 124.679 1.192 . . . . 0.0 113.234 173.489 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -86.95 116.08 24.77 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 114.335 1.235 . . . . 0.0 114.335 174.486 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -66.25 137.79 57.21 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 123.376 0.67 . . . . 0.0 112.013 177.615 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 13.4 t -112.43 -26.91 8.48 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 125.573 1.549 . . . . 0.0 114.012 175.807 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 27.4 t0 -93.64 149.98 20.79 Favored 'General case' 0 N--CA 1.473 0.721 0 O-C-N 120.857 -1.152 . . . . 0.0 108.323 175.069 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 536' ' ' THR . . . . . . . . . . . . 0.255 0.6 OUTLIER -59.2 -19.56 46.42 Favored 'General case' 0 N--CA 1.469 0.488 0 N-CA-C 115.998 1.851 . . . . 0.0 115.998 165.188 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 38.8 m-20 -82.19 -15.62 52.57 Favored 'General case' 0 CA--C 1.542 0.663 0 N-CA-C 117.625 2.454 . . . . 0.0 117.625 168.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 61.0 mt-10 -86.06 145.43 27.07 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 114.541 1.311 . . . . 0.0 114.541 -172.713 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -87.93 136.1 33.11 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 126.476 1.91 . . . . 0.0 110.415 174.369 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 38.9 tt0 -94.53 129.81 41.18 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 125.176 1.39 . . . . 0.0 110.83 177.478 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 81.4 mt -124.85 154.02 41.68 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 125.112 1.365 . . . . 0.0 112.146 -178.316 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 6.3 tmtm? -126.48 144.27 50.91 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 125.873 1.669 . . . . 0.0 108.223 168.739 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -47.84 117.74 2.0 Favored 'General case' 0 CA--C 1.543 0.709 0 CA-C-O 122.422 1.105 . . . . 0.0 112.267 177.598 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 103.96 -5.14 46.11 Favored Glycine 0 CA--C 1.529 0.968 0 C-N-CA 127.179 2.323 . . . . 0.0 113.577 178.287 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 75.4 m-20 -73.71 127.68 33.45 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 118.945 1.372 . . . . 0.0 114.436 -173.603 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 2.0 t -76.98 135.18 27.15 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 N-CA-C 112.473 0.546 . . . . 0.0 112.473 173.897 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 1.2 t -126.48 122.88 62.08 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 C-N-CA 125.199 1.4 . . . . 0.0 111.81 177.272 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 548' ' ' LEU . . . . . 0.531 ' CD2' ' HE2' ' A' ' 524' ' ' LYS . 17.5 mt -78.03 99.61 6.17 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 124.488 1.115 . . . . 0.0 108.636 174.56 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 549' ' ' VAL . . . . . . . . . . . . . 4.6 t -62.5 128.61 24.57 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.032 0 N-CA-C 113.666 0.987 . . . . 0.0 113.666 171.497 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 10.9 pt -119.45 153.68 53.94 Favored Pre-proline 0 N--CA 1.47 0.552 0 C-N-CA 126.138 1.775 . . . . 0.0 109.817 179.877 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 77.4 Cg_endo -67.11 142.73 62.48 Favored 'Trans proline' 0 N--CA 1.458 -0.596 0 C-N-CA 122.823 2.349 . . . . 0.0 110.443 175.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 552' ' ' PHE . . . . . 0.416 ' CE1' ' HA ' ' A' ' 558' ' ' GLN . 39.1 m-85 -64.35 140.43 58.87 Favored 'General case' 0 CA--C 1.53 0.179 0 N-CA-C 117.288 2.329 . . . . 0.0 117.288 -177.087 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 553' ' ' GLN . . . . . . . . . . . . . 19.5 pt20 -90.7 -15.41 30.36 Favored 'General case' 0 CA--C 1.54 0.565 0 N-CA-C 116.262 1.949 . . . . 0.0 116.262 -169.189 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -152.83 156.89 33.24 Favored Pre-proline 0 CA--C 1.544 0.741 0 C-N-CA 124.532 1.133 . . . . 0.0 110.248 168.459 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 555' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -70.86 -33.62 12.15 Favored 'Trans proline' 0 CA--C 1.535 0.529 0 C-N-CA 123.303 2.669 . . . . 0.0 112.01 -176.397 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -72.92 -14.54 61.48 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 113.211 0.819 . . . . 0.0 113.211 173.774 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 557' ' ' GLU . . . . . . . . . . . . . 65.6 mm-40 -85.77 -25.73 26.22 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 124.949 1.3 . . . . 0.0 112.6 179.515 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 558' ' ' GLN . . . . . 0.416 ' HA ' ' CE1' ' A' ' 552' ' ' PHE . 7.0 tt0 -82.44 107.41 15.08 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-O 122.035 0.921 . . . . 0.0 112.683 178.503 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . 0.296 9.1 m-20 -96.67 138.92 33.51 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 116.744 2.128 . . . . 0.0 116.744 172.775 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 17.3 tp10 -68.05 124.62 23.92 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.695 1.198 . . . . 0.0 111.007 -177.73 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 83.51 -2.99 86.42 Favored Glycine 0 CA--C 1.535 1.341 0 C-N-CA 125.134 1.349 . . . . 0.0 115.173 -171.409 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 50.2 m95 -98.93 161.3 13.7 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 125.312 1.445 . . . . 0.0 112.348 172.891 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 13.1 mt -137.31 154.94 49.98 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 124.688 1.195 . . . . 0.0 110.213 172.263 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 56.5 ttm -116.23 141.14 48.53 Favored 'General case' 0 N--CA 1.464 0.229 0 C-N-CA 124.717 1.207 . . . . 0.0 111.537 178.172 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -173.1 -171.87 38.16 Favored Glycine 0 CA--C 1.522 0.5 0 C-N-CA 123.341 0.496 . . . . 0.0 113.028 -179.836 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 13.2 p -133.17 140.97 45.9 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.634 0 C-N-CA 125.76 1.624 . . . . 0.0 108.916 171.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 35.4 mtmt -58.48 137.85 57.08 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 121.284 -0.885 . . . . 0.0 111.16 176.35 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -60.36 -41.76 94.39 Favored 'General case' 0 C--O 1.22 -0.45 0 CA-C-O 118.9 -0.571 . . . . 0.0 110.707 174.661 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 32.1 t -67.91 -20.18 65.07 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 119.151 0.887 . . . . 0.0 113.062 177.24 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 33.8 m-20 -78.57 -44.92 22.99 Favored 'General case' 0 CA--C 1.541 0.63 0 O-C-N 120.642 -1.287 . . . . 0.0 114.351 168.554 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 66.0 t-105 -72.63 -33.84 66.91 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 125.907 1.683 . . . . 0.0 113.618 177.898 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 44.3 t-20 -71.79 -21.64 61.69 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 127.063 2.145 . . . . 0.0 111.848 172.628 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 75.4 mt-30 -91.2 1.19 57.28 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.972 1.309 . . . . 0.0 113.544 164.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 93.4 m-70 59.68 28.75 18.24 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 126.782 2.033 . . . . 0.0 114.854 170.484 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 75.0 mttt -68.34 163.28 23.42 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 126.144 1.778 . . . . 0.0 111.855 179.245 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 4.8 pm0 -54.72 111.44 0.81 Allowed 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 113.653 0.983 . . . . 0.0 113.653 -175.143 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 50.5 tp -64.0 -34.71 78.63 Favored 'General case' 0 N--CA 1.469 0.504 0 O-C-N 120.659 -1.276 . . . . 0.0 111.223 -169.444 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 32.5 mp0 -72.86 -17.55 61.52 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 125.545 1.538 . . . . 0.0 113.737 -174.415 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 50.1 mmtt -118.91 -25.09 6.37 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 125.334 1.454 . . . . 0.0 114.256 179.223 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 98.0 m -71.32 -33.0 69.27 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 118.526 0.603 . . . . 0.0 112.128 169.211 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 15.1 ptp180 -63.25 165.14 7.77 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-O 121.888 0.851 . . . . 0.0 112.886 173.761 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -178.12 178.63 48.56 Favored Glycine 0 CA--C 1.523 0.531 0 CA-C-N 115.034 -0.985 . . . . 0.0 112.593 171.799 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 27.5 m -93.66 141.48 14.73 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.461 0 C-N-CA 123.758 0.823 . . . . 0.0 110.697 167.293 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 43.8 p90 -134.04 154.48 80.24 Favored Pre-proline 0 C--O 1.24 0.563 0 C-N-CA 124.997 1.319 . . . . 0.0 112.371 175.415 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -68.44 112.48 2.83 Favored 'Trans proline' 0 N--CA 1.459 -0.53 0 C-N-CA 121.86 1.707 . . . . 0.0 109.214 172.398 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 19.5 pt-20 -56.87 -26.98 59.82 Favored 'General case' 0 N--CA 1.476 0.844 0 O-C-N 121.252 -0.905 . . . . 0.0 112.428 -176.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 6.7 p-10 -64.81 -23.73 67.33 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 125.782 1.633 . . . . 0.0 113.594 177.023 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 23.0 m-85 -69.86 -11.63 61.01 Favored 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 117.074 2.25 . . . . 0.0 117.074 166.577 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 589' ' ' THR . . . . . . . . . . . . . 71.5 p -128.53 174.59 9.24 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 125.603 1.561 . . . . 0.0 110.546 -176.391 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -134.37 145.81 49.32 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 123.612 0.765 . . . . 0.0 110.711 169.596 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -58.83 135.14 57.42 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 124.959 1.303 . . . . 0.0 110.804 175.542 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 592' ' ' VAL . . . . . . . . . . . . . 3.1 m -123.35 155.68 64.84 Favored Pre-proline 0 CA--C 1.544 0.745 0 C-N-CA 126.013 1.725 . . . . 0.0 107.762 173.851 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 593' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo . . . . . 0 C--O 1.251 1.15 0 C-N-CA 123.62 2.88 . . . . 0.0 114.976 -169.406 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B 1728 ' ' SER . . . . . . . . . . . . . 30.6 t . . . . . 0 N--CA 1.474 0.73 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B 1729 ' ' THR . . . . . . . . . . . . 0.255 0.2 OUTLIER -133.31 -2.84 3.09 Favored 'General case' 0 N--CA 1.48 1.051 0 N-CA-C 117.486 2.402 . . . . 0.0 117.486 -156.844 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B 1730 ' ' VAL . . . . . . . . . . . . . 16.9 m -141.06 133.88 14.36 Favored Pre-proline 0 CA--C 1.543 0.685 0 C-N-CA 125.827 1.651 . . . . 0.0 108.844 162.365 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -70.3 173.98 10.65 Favored 'Trans proline' 0 CA--C 1.54 0.798 0 C-N-CA 123.732 2.955 . . . . 0.0 113.511 179.432 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 7.1 t -134.26 129.54 53.49 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 C-N-CA 125.796 1.638 . . . . 0.0 112.123 -176.53 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -69.55 133.79 88.78 Favored Pre-proline 0 CA--C 1.555 1.161 0 O-C-N 121.558 -0.714 . . . . 0.0 112.596 -177.04 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -80.05 164.06 22.55 Favored 'Trans proline' 0 CA--C 1.547 1.161 0 C-N-CA 123.274 2.649 . . . . 0.0 113.353 -177.888 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 77.1 Cg_exo -56.21 149.45 54.51 Favored 'Trans proline' 0 CA--C 1.54 0.79 0 C-N-CA 123.716 2.944 . . . . 0.0 114.907 -178.764 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B 1736 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -129.02 169.84 14.21 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 125.876 1.67 . . . . 0.0 111.566 177.499 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B 1737 ' ' ARG . . . . . . . . . . . . . 75.9 mtp85 -118.38 171.89 7.84 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 125.66 1.584 . . . . 0.0 114.0 -169.896 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B 1738 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.17 158.66 34.85 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 124.183 0.993 . . . . 0.0 113.433 -179.604 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B 1739 ' ' ARG . . . . . . . . . . . . . 5.4 tpp180 -147.48 149.92 33.59 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 124.321 1.048 . . . . 0.0 113.664 -162.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B 1740 ' ' GLY . . . . . . . . . . . . . . . 74.72 165.22 13.19 Favored Glycine 0 CA--C 1.534 1.245 0 N-CA-C 116.942 1.537 . . . . 0.0 116.942 157.23 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B 1741 ' ' ARG . . . . . . . . . . . . . 7.6 tpp85 -149.38 35.3 0.72 Allowed 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 125.266 1.426 . . . . 0.0 112.376 176.708 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B 1742 ' ' ASN . . . . . . . . . . . . . 21.5 p30 -77.7 5.99 8.26 Favored 'General case' 0 CA--C 1.553 1.064 0 N-CA-C 116.559 2.059 . . . . 0.0 116.559 -172.593 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B 1743 ' ' LEU . . . . . . . . . . . . . 1.4 pt? -61.48 149.4 38.84 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 119.55 1.068 . . . . 0.0 113.57 172.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B 1744 ' ' THR . . . . . . . . . . . . 0.277 0.2 OUTLIER . . . . . 0 C--O 1.252 1.21 0 N-CA-C 117.979 2.585 . . . . 0.0 117.979 -173.918 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 513' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.391 0 N-CA-C 111.996 -0.442 . . . . 0.0 111.996 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 514' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -100.58 152.48 20.37 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 126.634 1.974 . . . . 0.0 112.194 177.103 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 65.8 mt -99.43 -24.42 14.8 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.293 1.037 . . . . 0.0 113.395 177.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 516' ' ' ASP . . . . . . . . . . . . . 46.3 p-10 -150.34 179.41 8.15 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.253 1.421 . . . . 0.0 113.689 -173.097 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 10.3 mt -107.08 166.37 11.19 Favored Pre-proline 0 CA--C 1.55 0.972 0 C-N-CA 126.839 2.055 . . . . 0.0 111.966 173.649 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -73.15 160.51 45.24 Favored 'Trans proline' 0 CA--C 1.539 0.757 0 C-N-CA 123.677 2.918 . . . . 0.0 113.394 -174.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -62.81 135.0 49.66 Favored 'Trans proline' 0 N--CA 1.459 -0.547 0 C-N-CA 123.353 2.702 . . . . 0.0 110.228 178.867 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 76.82 -1.34 62.93 Favored Glycine 0 CA--C 1.534 1.254 0 CA-C-O 117.295 -1.836 . . . . 0.0 115.508 -178.139 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 49.0 t80 -41.29 131.69 2.73 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 120.683 2.241 . . . . 0.0 115.741 -177.317 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 65.6 mtm -105.52 -56.27 2.2 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 123.269 0.628 . . . . 0.0 111.595 179.547 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 523' ' ' PHE . . . . . . . . . . . . . 21.9 p90 -161.33 168.24 24.31 Favored 'General case' 0 C--O 1.224 -0.239 0 C-N-CA 125.88 1.672 . . . . 0.0 113.35 -173.417 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 524' ' ' LYS . . . . . 0.533 ' HE2' ' CD2' ' A' ' 548' ' ' LEU . 41.9 mttt -98.44 163.58 12.63 Favored 'General case' 0 N--CA 1.469 0.506 0 O-C-N 121.223 -0.923 . . . . 0.0 112.155 165.371 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 13.7 m -133.91 158.48 42.41 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 C-N-CA 126.706 2.002 . . . . 0.0 109.171 164.228 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 54.8 tt0 -122.0 131.57 54.07 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 119.12 0.873 . . . . 0.0 112.034 170.701 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 527' ' ' ALA . . . . . . . . . . . . . . . -64.15 125.38 24.34 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 121.115 -0.991 . . . . 0.0 112.68 179.166 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 58.8 mm-40 -89.54 -23.94 21.88 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 125.791 1.636 . . . . 0.0 112.024 174.04 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 96.6 m-70 -141.28 162.53 35.27 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 126.768 2.027 . . . . 0.0 110.699 -175.323 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -80.67 128.1 33.24 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 125.68 1.592 . . . . 0.0 113.825 176.782 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 86.2 t80 -129.27 115.67 17.97 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.521 1.129 . . . . 0.0 113.933 179.18 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -79.36 121.84 25.63 Favored 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 116.139 1.904 . . . . 0.0 116.139 175.365 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -71.33 124.49 24.67 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 118.723 0.692 . . . . 0.0 111.455 175.533 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 9.8 t -129.41 37.93 3.94 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 127.095 2.158 . . . . 0.0 110.089 -177.399 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 18.6 t0 -161.78 158.2 25.35 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.804 1.642 . . . . 0.0 107.67 166.211 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 3.1 t -62.73 -21.32 65.71 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 114.982 1.475 . . . . 0.0 114.982 164.539 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 29.0 t0 -74.95 -30.07 61.12 Favored 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 125.343 1.457 . . . . 0.0 110.364 173.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 67.7 mt-10 -84.64 154.74 22.35 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 115.515 1.672 . . . . 0.0 115.515 -164.872 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -102.88 134.04 46.96 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 127.449 2.3 . . . . 0.0 110.217 174.118 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 29.5 tt0 -87.63 128.72 35.27 Favored 'General case' 0 CA--C 1.537 0.457 0 O-C-N 121.483 -0.761 . . . . 0.0 110.965 174.661 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 78.2 mt -120.82 146.76 46.2 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 123.971 0.908 . . . . 0.0 111.088 178.53 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 7.3 tmtm? -121.86 144.94 48.54 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 125.447 1.499 . . . . 0.0 108.693 170.47 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -55.24 109.81 0.59 Allowed 'General case' 0 CA--C 1.548 0.871 0 CA-C-O 121.601 0.715 . . . . 0.0 111.622 -177.74 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 118.1 -11.13 13.24 Favored Glycine 0 CA--C 1.534 1.242 0 C-N-CA 126.857 2.17 . . . . 0.0 114.652 -175.539 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 85.9 m-20 -70.38 120.17 15.64 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 119.604 1.702 . . . . 0.0 114.017 -173.795 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 1.8 t -72.39 135.6 27.45 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.088 0 CA-C-N 119.051 0.841 . . . . 0.0 112.547 167.22 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 1.1 t -126.93 122.49 60.49 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.455 0 C-N-CA 126.236 1.814 . . . . 0.0 111.708 177.635 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 548' ' ' LEU . . . . . 0.533 ' CD2' ' HE2' ' A' ' 524' ' ' LYS . 19.1 mt -77.92 101.45 6.84 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 124.845 1.258 . . . . 0.0 108.787 174.548 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 549' ' ' VAL . . . . . . . . . . . . . 5.0 t -63.6 131.42 29.16 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.076 0 N-CA-C 114.252 1.204 . . . . 0.0 114.252 173.497 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 3.8 pt -130.51 154.53 81.65 Favored Pre-proline 0 CA--C 1.547 0.854 0 C-N-CA 127.027 2.131 . . . . 0.0 109.318 177.3 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo -71.9 143.85 41.92 Favored 'Trans proline' 0 CA--C 1.536 0.62 0 C-N-CA 123.442 2.762 . . . . 0.0 110.989 174.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 19.3 m-85 -56.52 153.1 10.61 Favored 'General case' 0 N--CA 1.466 0.344 0 N-CA-C 117.739 2.496 . . . . 0.0 117.739 -170.604 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 553' ' ' GLN . . . . . . . . . . . . . 7.4 pt20 -61.65 -29.77 70.28 Favored 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 113.827 1.047 . . . . 0.0 113.827 175.134 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 9.7 m-20 -156.81 154.96 27.76 Favored Pre-proline 0 CA--C 1.545 0.779 0 CA-C-N 119.51 1.05 . . . . 0.0 113.024 173.374 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 555' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -71.65 -29.06 16.48 Favored 'Trans proline' 0 CA--C 1.54 0.82 0 C-N-CA 123.932 3.088 . . . . 0.0 113.364 178.055 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 26.0 pt-20 -72.71 -26.13 61.48 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 124.04 0.936 . . . . 0.0 112.145 170.146 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 557' ' ' GLU . . . . . . . . . . . . . 34.6 mm-40 -78.94 -28.92 43.81 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 125.657 1.583 . . . . 0.0 114.603 178.3 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 38.3 tt0 -67.13 127.67 33.49 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 123.311 0.645 . . . . 0.0 112.685 -175.17 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -101.06 144.92 29.4 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 124.673 1.189 . . . . 0.0 108.496 -173.583 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 43.0 tp10 -73.64 124.36 25.8 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.407 1.083 . . . . 0.0 111.787 -174.694 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 82.01 2.07 90.47 Favored Glycine 0 CA--C 1.54 1.646 0 C-N-CA 124.374 0.987 . . . . 0.0 115.273 -175.844 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 45.2 m95 -97.9 165.98 11.67 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 126.132 1.773 . . . . 0.0 113.427 176.3 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 14.7 mt -133.46 161.28 34.98 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 124.702 1.201 . . . . 0.0 110.654 168.239 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 50.6 ttm -119.29 144.51 46.76 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 125.362 1.465 . . . . 0.0 111.52 176.21 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -173.68 -173.43 39.88 Favored Glycine 0 CA--C 1.527 0.801 0 C-N-CA 124.275 0.941 . . . . 0.0 113.399 177.384 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 13.9 p -130.92 141.73 45.42 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 C-N-CA 126.265 1.826 . . . . 0.0 108.907 172.76 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 26.7 mtmt -61.35 139.44 58.18 Favored 'General case' 0 N--CA 1.468 0.459 0 O-C-N 120.867 -1.146 . . . . 0.0 111.771 177.9 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 20.8 tt0 -61.77 -42.31 98.82 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-O 118.288 -0.863 . . . . 0.0 111.17 178.639 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 24.6 t -65.43 -30.55 71.36 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-N 119.36 0.982 . . . . 0.0 112.61 177.041 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 89.0 m-20 -67.28 -43.58 81.41 Favored 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 114.555 1.317 . . . . 0.0 114.555 171.691 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 64.3 t-105 -71.91 -26.69 62.41 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.885 1.274 . . . . 0.0 113.285 172.694 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 7.3 t-20 -74.47 -31.15 62.13 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.862 1.665 . . . . 0.0 111.093 171.792 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 64.5 mm-40 -77.41 -7.08 55.57 Favored 'General case' 0 N--CA 1.477 0.894 0 CA-C-N 119.09 0.859 . . . . 0.0 113.23 166.799 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 12.1 m-70 63.24 32.09 15.1 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 127.284 2.234 . . . . 0.0 112.728 178.335 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 28.6 mttm -63.27 157.29 23.15 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 125.073 1.349 . . . . 0.0 112.649 179.53 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 3.9 pm0 -52.81 101.19 0.04 OUTLIER 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 124.865 1.266 . . . . 0.0 113.055 -179.448 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 26.4 tp -59.08 -47.95 83.39 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 124.165 0.986 . . . . 0.0 111.351 -163.428 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 21.0 mp0 -73.17 -18.55 61.25 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 115.461 -0.791 . . . . 0.0 112.098 -168.377 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 57.3 tptt -95.56 -36.02 11.43 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 124.69 1.196 . . . . 0.0 112.92 170.022 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 6.3 t -77.9 -22.27 49.95 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 124.112 0.965 . . . . 0.0 112.901 -174.164 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 32.0 ptt180 -64.26 163.11 13.42 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.802 1.241 . . . . 0.0 112.327 171.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -170.56 173.65 44.43 Favored Glycine 0 CA--C 1.526 0.769 0 C-N-CA 123.874 0.749 . . . . 0.0 113.95 175.654 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 19.5 m -91.55 144.16 9.78 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 C-N-CA 124.641 1.176 . . . . 0.0 112.064 170.704 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 47.5 p90 -140.9 153.74 67.8 Favored Pre-proline 0 CA--C 1.543 0.684 0 C-N-CA 124.782 1.233 . . . . 0.0 113.202 177.094 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -65.79 112.16 2.13 Favored 'Trans proline' 0 C--N 1.347 0.484 0 C-N-CA 122.195 1.93 . . . . 0.0 109.543 169.906 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 21.9 pt-20 -54.37 -31.14 54.0 Favored 'General case' 0 N--CA 1.473 0.721 0 O-C-N 121.735 -0.603 . . . . 0.0 112.243 -178.388 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 9.7 p-10 -68.46 -17.36 64.17 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 126.642 1.977 . . . . 0.0 114.318 -179.86 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 19.4 m-85 -72.13 -11.08 60.58 Favored 'General case' 0 CA--C 1.534 0.365 0 N-CA-C 116.269 1.951 . . . . 0.0 116.269 164.369 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 589' ' ' THR . . . . . . . . . . . . . 71.5 p -129.85 166.42 20.0 Favored 'General case' 0 C--O 1.234 0.237 0 C-N-CA 125.809 1.644 . . . . 0.0 112.037 -173.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -122.93 134.34 54.36 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 123.547 0.739 . . . . 0.0 110.377 176.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.84 123.93 21.92 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 125.808 1.643 . . . . 0.0 109.555 -177.548 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 592' ' ' VAL . . . . . . . . . . . . . 6.9 m -113.76 153.4 45.98 Favored Pre-proline 0 CA--C 1.552 1.034 0 C-N-CA 124.854 1.262 . . . . 0.0 109.306 -177.211 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 593' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_endo . . . . . 0 C--O 1.253 1.264 0 C-N-CA 125.29 3.994 . . . . 0.0 115.532 -169.835 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B 1728 ' ' SER . . . . . . . . . . . . . 35.9 p . . . . . 0 N--CA 1.472 0.632 0 CA-C-O 119.374 -0.346 . . . . 0.0 111.23 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B 1729 ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -81.92 -29.05 32.48 Favored 'General case' 0 N--CA 1.477 0.917 0 N-CA-C 117.095 2.257 . . . . 0.0 117.095 -176.793 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B 1730 ' ' VAL . . . . . . . . . . . . . 12.7 m -77.14 151.09 81.31 Favored Pre-proline 0 N--CA 1.476 0.843 0 C-N-CA 124.463 1.105 . . . . 0.0 113.159 -177.491 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 70.5 Cg_endo -68.49 175.46 6.96 Favored 'Trans proline' 0 CA--C 1.543 0.931 0 C-N-CA 123.233 2.622 . . . . 0.0 113.405 169.857 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 15.6 t -124.75 137.88 55.96 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 C-N-CA 125.159 1.384 . . . . 0.0 111.924 175.476 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -68.44 143.27 95.28 Favored Pre-proline 0 CA--C 1.554 1.112 0 O-C-N 121.537 -0.727 . . . . 0.0 112.631 179.086 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 26.6 Cg_endo -76.87 164.52 29.84 Favored 'Trans proline' 0 CA--C 1.548 1.2 0 C-N-CA 122.893 2.395 . . . . 0.0 113.51 177.221 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -70.28 139.19 37.85 Favored 'Trans proline' 0 CA--C 1.541 0.849 0 C-N-CA 123.455 2.77 . . . . 0.0 112.131 176.44 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B 1736 ' ' ARG . . . . . . . . . . . . . 23.5 mtp180 -97.74 174.57 6.54 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 126.457 1.903 . . . . 0.0 115.531 -170.71 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B 1737 ' ' ARG . . . . . . . . . . . . . 25.0 mtp85 54.94 79.85 0.14 Allowed 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 127.366 2.266 . . . . 0.0 112.823 172.348 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B 1738 ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -74.4 -26.68 60.24 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 127.56 2.344 . . . . 0.0 114.101 -176.411 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B 1739 ' ' ARG . . . . . . . . . . . . . 10.8 ptt85 -35.89 122.55 0.68 Allowed 'General case' 0 N--CA 1.484 1.243 0 N-CA-C 116.873 2.175 . . . . 0.0 116.873 -169.185 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B 1740 ' ' GLY . . . . . . . . . . . . . . . 172.77 -149.55 11.56 Favored Glycine 0 CA--C 1.534 1.239 0 C-N-CA 125.656 1.598 . . . . 0.0 112.72 -178.557 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B 1741 ' ' ARG . . . . . . . . . . . . . 48.2 ttt-85 -43.55 130.63 5.21 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 126.015 1.726 . . . . 0.0 112.907 174.565 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B 1742 ' ' ASN . . . . . . . . . . . . . 34.4 t30 -76.09 142.54 41.69 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 118.433 0.561 . . . . 0.0 110.987 168.793 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B 1743 ' ' LEU . . . . . . . . . . . . . 4.4 pp -129.21 153.7 47.49 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.529 1.131 . . . . 0.0 112.597 174.461 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B 1744 ' ' THR . . . . . . . . . . . . . 2.3 m . . . . . 0 C--O 1.253 1.27 0 C-N-CA 127.142 2.177 . . . . 0.0 114.24 176.01 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 513' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.784 0 N-CA-C 110.847 -0.901 . . . . 0.0 110.847 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 514' ' ' ARG . . . . . . . . . . . . . 3.8 ppt_? -63.62 165.37 8.26 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 126.879 2.071 . . . . 0.0 114.044 -179.388 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 88.6 mt -104.65 -56.28 2.21 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 126.18 1.792 . . . . 0.0 110.058 163.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 516' ' ' ASP . . . . . . . . . . . . . 61.3 m-20 -97.59 146.47 25.26 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 117.033 2.235 . . . . 0.0 117.033 -176.497 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 11.7 mt -79.14 163.91 57.41 Favored Pre-proline 0 CA--C 1.553 1.093 0 C-N-CA 124.451 1.101 . . . . 0.0 111.069 161.153 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -67.97 160.07 50.15 Favored 'Trans proline' 0 CA--C 1.541 0.842 0 C-N-CA 123.671 2.914 . . . . 0.0 113.222 -177.078 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -62.61 134.15 46.12 Favored 'Trans proline' 0 CA--C 1.535 0.562 0 C-N-CA 123.05 2.5 . . . . 0.0 111.037 -177.598 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 74.42 -2.1 47.7 Favored Glycine 0 CA--C 1.535 1.337 0 CA-C-O 117.628 -1.651 . . . . 0.0 115.751 -178.675 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 31.3 t80 -31.69 123.7 0.27 Allowed 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 117.827 2.528 . . . . 0.0 117.827 -176.795 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 46.2 mtm -94.81 -53.1 3.98 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 112.413 0.523 . . . . 0.0 112.413 -176.095 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 523' ' ' PHE . . . . . . . . . . . . . 28.1 p90 -169.55 174.26 5.99 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 126.556 1.943 . . . . 0.0 112.872 -173.591 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 524' ' ' LYS . . . . . 0.434 ' HE2' ' CD2' ' A' ' 548' ' ' LEU . 50.9 mttt -106.58 163.81 12.58 Favored 'General case' 0 N--CA 1.47 0.543 0 O-C-N 120.818 -1.176 . . . . 0.0 112.653 169.207 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 12.5 m -133.3 160.91 42.16 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.925 0 C-N-CA 126.626 1.97 . . . . 0.0 110.065 165.413 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 25.6 tt0 -124.5 127.37 47.35 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 119.709 1.14 . . . . 0.0 112.919 172.733 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 527' ' ' ALA . . . . . . . . . . . . . . . -64.6 123.71 19.98 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.618 1.167 . . . . 0.0 112.738 -178.45 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 35.5 mm-40 -89.68 -25.35 21.27 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 125.426 1.49 . . . . 0.0 111.87 175.276 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 94.3 m-70 -138.62 164.66 28.91 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 127.745 2.418 . . . . 0.0 110.121 179.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -87.73 138.64 31.29 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 107.092 -1.447 . . . . 0.0 107.092 177.098 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 66.9 t80 -127.43 115.74 19.38 Favored 'General case' 0 C--N 1.332 -0.187 0 C-N-CA 125.586 1.555 . . . . 0.0 113.648 -179.194 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -84.15 128.45 34.57 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 114.722 1.379 . . . . 0.0 114.722 -177.56 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -72.11 108.64 5.41 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 121.778 0.799 . . . . 0.0 111.139 -179.309 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 12.3 t -80.53 -17.97 49.91 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 114.388 1.255 . . . . 0.0 114.388 -177.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 24.8 m-20 -148.57 168.84 21.71 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 127.205 2.202 . . . . 0.0 114.9 -171.262 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 2.0 t -61.06 -34.78 75.43 Favored 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 117.012 2.227 . . . . 0.0 117.012 -173.284 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 45.3 m-20 -81.34 -15.21 56.04 Favored 'General case' 0 CA--C 1.539 0.558 0 N-CA-C 114.971 1.471 . . . . 0.0 114.971 177.643 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 24.3 mp0 -83.71 134.37 34.76 Favored 'General case' 0 CA--C 1.543 0.707 0 O-C-N 120.873 -1.142 . . . . 0.0 113.849 -166.412 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -83.9 128.63 34.68 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.922 1.689 . . . . 0.0 110.442 178.93 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 8.6 tt0 -90.1 132.41 35.44 Favored 'General case' 0 CA--C 1.537 0.48 0 O-C-N 121.667 -0.645 . . . . 0.0 111.932 177.827 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 73.1 mt -123.68 146.43 48.24 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.722 1.209 . . . . 0.0 112.643 -174.741 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -114.3 141.17 47.93 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 125.05 1.34 . . . . 0.0 110.126 170.272 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -56.2 104.91 0.16 Allowed 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 123.75 0.82 . . . . 0.0 111.895 179.622 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 125.38 -12.74 7.48 Favored Glycine 0 CA--C 1.532 1.147 0 C-N-CA 126.616 2.055 . . . . 0.0 114.296 -174.161 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 90.0 m-20 -74.14 125.43 28.33 Favored 'General case' 0 C--O 1.231 0.12 0 N-CA-C 115.227 1.565 . . . . 0.0 115.227 -173.183 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 2.6 t -73.85 134.33 29.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 C-N-CA 122.921 0.488 . . . . 0.0 111.394 167.041 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 1.4 t -121.92 121.6 64.59 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.593 0 C-N-CA 124.9 1.28 . . . . 0.0 111.308 174.108 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 548' ' ' LEU . . . . . 0.434 ' CD2' ' HE2' ' A' ' 524' ' ' LYS . 18.3 mt -77.17 100.22 5.7 Favored 'General case' 0 CA--C 1.539 0.525 0 N-CA-C 108.055 -1.091 . . . . 0.0 108.055 175.895 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 549' ' ' VAL . . . . . . . . . . . . . 4.1 t -62.03 129.31 24.96 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.92 0 N-CA-C 113.652 0.982 . . . . 0.0 113.652 171.572 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 8.3 pt -123.69 154.67 66.9 Favored Pre-proline 0 CA--C 1.54 0.592 0 C-N-CA 125.965 1.706 . . . . 0.0 109.447 179.581 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -65.39 142.28 71.71 Favored 'Trans proline' 0 N--CA 1.458 -0.593 0 C-N-CA 122.711 2.274 . . . . 0.0 110.026 174.686 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 34.5 m-85 -58.33 140.0 54.26 Favored 'General case' 0 C--O 1.235 0.335 0 N-CA-C 116.807 2.151 . . . . 0.0 116.807 -175.555 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 553' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -61.12 -27.69 68.57 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 114.6 1.333 . . . . 0.0 114.6 178.093 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 6.4 m-20 -156.73 153.15 23.85 Favored Pre-proline 0 CA--C 1.542 0.652 0 C-N-CA 125.876 1.67 . . . . 0.0 111.73 174.225 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 555' ' ' PRO . . . . . . . . . . . . . 62.8 Cg_endo -68.09 -33.25 25.81 Favored 'Trans proline' 0 CA--C 1.537 0.637 0 C-N-CA 123.592 2.861 . . . . 0.0 112.761 -177.326 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 26.5 pt-20 -76.71 -16.96 59.37 Favored 'General case' 0 CA--C 1.544 0.713 0 O-C-N 121.393 -0.817 . . . . 0.0 113.074 174.053 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 557' ' ' GLU . . . . . . . . . . . . . 55.4 mm-40 -78.94 -17.75 54.97 Favored 'General case' 0 CA--C 1.545 0.766 0 O-C-N 121.165 -0.96 . . . . 0.0 113.005 176.167 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 49.1 tt0 -76.79 129.22 35.97 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 125.299 1.44 . . . . 0.0 111.988 174.694 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -114.73 149.77 36.34 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 126.189 1.795 . . . . 0.0 113.083 171.517 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 57.0 tt0 -69.9 122.99 20.37 Favored 'General case' 0 CA--C 1.538 0.49 0 O-C-N 121.142 -0.974 . . . . 0.0 111.436 -173.493 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 85.43 -2.23 88.13 Favored Glycine 0 CA--C 1.535 1.343 0 C-N-CA 125.059 1.314 . . . . 0.0 115.059 -176.519 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 59.1 m95 -95.08 154.1 17.34 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 126.025 1.73 . . . . 0.0 112.643 174.008 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 13.1 mt -131.04 159.73 36.68 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 123.18 0.592 . . . . 0.0 111.161 168.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 48.3 ttm -117.27 139.55 50.67 Favored 'General case' 0 CA--C 1.527 0.091 0 C-N-CA 125.384 1.474 . . . . 0.0 110.712 -179.668 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -170.37 -175.75 39.39 Favored Glycine 0 CA--C 1.523 0.584 0 C-N-CA 123.943 0.783 . . . . 0.0 112.49 -178.896 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 14.9 p -128.04 138.82 53.61 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.444 0 C-N-CA 125.406 1.482 . . . . 0.0 108.578 169.526 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 38.7 mtmt -58.09 134.43 56.43 Favored 'General case' 0 N--CA 1.465 0.307 0 O-C-N 121.377 -0.827 . . . . 0.0 110.559 176.198 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -58.92 -42.99 91.0 Favored 'General case' 0 C--O 1.22 -0.469 0 CA-C-O 118.773 -0.632 . . . . 0.0 109.749 175.552 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 57.4 p -60.0 -22.59 62.77 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 115.508 1.67 . . . . 0.0 115.508 174.074 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 53.9 m-20 -85.13 -45.31 12.19 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.962 1.305 . . . . 0.0 114.219 173.862 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 59.4 t-105 -67.57 -35.86 79.84 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.323 1.449 . . . . 0.0 112.826 174.857 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 9.7 t-20 -77.7 -14.44 59.61 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 126.21 1.804 . . . . 0.0 112.852 175.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 57.4 mm-40 -90.81 0.46 57.45 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 125.198 1.399 . . . . 0.0 112.666 162.106 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 93.6 m-70 59.58 34.85 22.46 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 127.871 2.468 . . . . 0.0 114.044 175.894 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 6.6 mtpm? -74.45 147.78 41.68 Favored 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 125.217 1.407 . . . . 0.0 110.659 177.806 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 6.7 pm0 -51.94 103.58 0.07 Allowed 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 126.585 1.954 . . . . 0.0 114.505 -175.397 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 57.5 tp -51.38 -49.63 61.14 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 126.236 1.814 . . . . 0.0 113.27 -171.713 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 92.6 mt-10 -66.02 -13.43 59.91 Favored 'General case' 0 CA--C 1.546 0.805 0 N-CA-C 114.154 1.168 . . . . 0.0 114.154 -175.757 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 33.5 mmtp -106.7 -30.13 9.16 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 125.381 1.472 . . . . 0.0 112.963 171.818 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 84.0 m -82.9 -23.04 33.75 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 114.221 1.193 . . . . 0.0 114.221 -176.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 40.3 ptt180 -63.64 162.61 12.77 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.907 1.283 . . . . 0.0 112.753 173.287 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -175.43 176.21 47.31 Favored Glycine 0 CA--C 1.529 0.929 0 CA-C-N 115.282 -0.872 . . . . 0.0 115.132 170.525 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 34.1 m -93.36 140.88 15.61 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 C-N-CA 124.819 1.247 . . . . 0.0 112.242 169.482 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 50.8 p90 -140.37 155.92 69.88 Favored Pre-proline 0 CA--C 1.544 0.721 0 C-N-CA 125.259 1.423 . . . . 0.0 112.484 176.738 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_endo -71.11 112.37 3.29 Favored 'Trans proline' 0 CA--C 1.533 0.467 0 C-N-CA 122.535 2.157 . . . . 0.0 109.667 171.158 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 20.2 pt-20 -57.56 -26.06 60.88 Favored 'General case' 0 N--CA 1.476 0.871 0 O-C-N 121.286 -0.884 . . . . 0.0 112.441 179.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 10.1 p-10 -71.75 -10.72 60.19 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 125.683 1.593 . . . . 0.0 114.859 177.268 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 18.6 m-85 -75.65 -13.83 60.34 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 117.003 2.223 . . . . 0.0 117.003 160.051 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 589' ' ' THR . . . . . . . . . . . . . 73.4 p -122.13 175.8 6.17 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 126.339 1.856 . . . . 0.0 110.477 -175.91 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -124.59 137.78 54.37 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 124.145 0.978 . . . . 0.0 108.803 170.003 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.67 125.56 27.78 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 123.742 0.817 . . . . 0.0 109.151 179.666 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 592' ' ' VAL . . . . . . . . . . . . . 7.1 m -112.22 156.61 41.76 Favored Pre-proline 0 N--CA 1.479 1.022 0 C-N-CA 124.911 1.284 . . . . 0.0 109.774 -175.586 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 593' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo . . . . . 0 C--O 1.252 1.214 0 C-N-CA 124.508 3.472 . . . . 0.0 113.437 -175.196 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B 1728 ' ' SER . . . . . . . . . . . . . 41.6 p . . . . . 0 N--CA 1.475 0.806 0 CA-C-O 120.786 0.327 . . . . 0.0 111.0 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B 1729 ' ' THR . . . . . . . . . . . . . 15.0 t -105.25 -17.75 14.36 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 125.847 1.659 . . . . 0.0 114.446 -175.73 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B 1730 ' ' VAL . . . . . . . . . . . . . 22.1 m -68.78 150.15 97.71 Favored Pre-proline 0 N--CA 1.476 0.838 0 O-C-N 121.512 -0.742 . . . . 0.0 112.247 174.221 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -69.16 166.32 27.27 Favored 'Trans proline' 0 CA--C 1.54 0.8 0 C-N-CA 123.44 2.76 . . . . 0.0 112.784 171.263 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 4.1 t -135.44 135.14 51.97 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 C-N-CA 124.978 1.311 . . . . 0.0 112.83 178.631 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -61.62 136.63 94.69 Favored Pre-proline 0 CA--C 1.554 1.127 0 O-C-N 121.636 -0.665 . . . . 0.0 112.253 178.321 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -71.52 168.08 24.58 Favored 'Trans proline' 0 CA--C 1.543 0.972 0 C-N-CA 123.305 2.67 . . . . 0.0 111.586 171.712 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -63.94 165.48 18.81 Favored 'Trans proline' 0 CA--C 1.542 0.889 0 C-N-CA 122.739 2.293 . . . . 0.0 113.211 -179.564 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B 1736 ' ' ARG . . . . . . . . . . . . . 10.7 mtm180 -142.83 171.68 13.72 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 127.696 2.398 . . . . 0.0 107.168 178.635 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B 1737 ' ' ARG . . . . . . . . . . . . . 22.4 ptt-85 -146.77 159.47 43.46 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 113.461 0.912 . . . . 0.0 113.461 -174.477 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B 1738 ' ' ARG . . . . . . . . . . . . . 6.0 tpp180 -74.97 131.04 40.37 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 125.573 1.549 . . . . 0.0 111.723 -176.009 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B 1739 ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -80.62 151.5 28.99 Favored 'General case' 0 N--CA 1.477 0.92 0 N-CA-C 114.255 1.205 . . . . 0.0 114.255 -178.366 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B 1740 ' ' GLY . . . . . . . . . . . . . . . -57.14 -30.09 60.45 Favored Glycine 0 CA--C 1.536 1.368 0 C-N-CA 125.834 1.683 . . . . 0.0 117.104 -166.405 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B 1741 ' ' ARG . . . . . . . . . . . . . 3.2 mmp_? -57.21 -4.88 0.23 Allowed 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 125.828 1.651 . . . . 0.0 115.146 171.37 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B 1742 ' ' ASN . . . . . . . . . . . . . 20.5 t-20 -59.29 -11.19 3.74 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 126.727 2.011 . . . . 0.0 115.72 163.592 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B 1743 ' ' LEU . . . . . . . . . . . . . 1.3 pt? -64.7 165.13 10.85 Favored 'General case' 0 CA--C 1.549 0.927 0 CA-C-N 119.667 1.121 . . . . 0.0 113.787 174.051 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B 1744 ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.252 1.205 0 N-CA-C 118.911 2.93 . . . . 0.0 118.911 -173.889 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 513' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.925 0 N-CA-C 110.386 -1.086 . . . . 0.0 110.386 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 514' ' ' ARG . . . . . . . . . . . . . 3.3 ppt_? -88.15 166.06 14.66 Favored 'General case' 0 N--CA 1.476 0.859 0 N-CA-C 114.264 1.209 . . . . 0.0 114.264 -172.754 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -93.77 -57.99 2.39 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.343 1.057 . . . . 0.0 109.618 165.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 516' ' ' ASP . . . . . . . . . . . . . 17.9 p30 -124.47 166.09 16.63 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 117.509 2.411 . . . . 0.0 117.509 -169.519 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 10.5 mt -81.07 161.72 61.96 Favored Pre-proline 0 CA--C 1.551 0.99 0 C-N-CA 125.55 1.54 . . . . 0.0 111.945 160.028 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -69.27 161.35 46.24 Favored 'Trans proline' 0 CA--C 1.537 0.648 0 C-N-CA 124.02 3.146 . . . . 0.0 113.782 -175.643 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 65.8 Cg_endo -61.87 142.06 92.04 Favored 'Trans proline' 0 N--CA 1.458 -0.569 0 C-N-CA 122.732 2.288 . . . . 0.0 110.283 178.139 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 67.37 3.56 26.03 Favored Glycine 0 CA--C 1.533 1.186 0 CA-C-O 117.198 -1.89 . . . . 0.0 116.177 -178.369 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 27.9 t80 -40.56 137.28 1.15 Allowed 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 116.886 2.18 . . . . 0.0 116.886 -178.119 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 57.1 mtm -112.91 -53.87 2.67 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 113.435 0.902 . . . . 0.0 113.435 -174.748 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 523' ' ' PHE . . . . . . . . . . . . . 26.1 p90 -167.36 174.32 8.12 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 126.612 1.965 . . . . 0.0 111.389 -178.205 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 524' ' ' LYS . . . . . 0.475 ' HE2' ' CD2' ' A' ' 548' ' ' LEU . 78.1 mttt -109.41 161.95 14.82 Favored 'General case' 0 N--CA 1.467 0.414 0 O-C-N 121.413 -0.804 . . . . 0.0 111.226 171.759 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 5.6 m -130.23 163.83 34.74 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 C-N-CA 126.261 1.824 . . . . 0.0 110.202 165.411 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 60.8 tt0 -129.52 130.81 46.26 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 118.836 0.744 . . . . 0.0 112.694 169.586 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 527' ' ' ALA . . . . . . . . . . . . . . . -64.07 119.14 9.58 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.604 1.162 . . . . 0.0 112.335 -178.06 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 46.9 mm-40 -86.13 -22.23 27.18 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.229 1.411 . . . . 0.0 111.417 171.762 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 89.1 m-70 -140.87 157.69 45.02 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 126.404 1.882 . . . . 0.0 110.455 178.033 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -84.77 141.79 30.27 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 -178.656 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 76.9 t80 -136.45 120.7 17.91 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 125.895 1.678 . . . . 0.0 112.306 -179.532 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 1.9 m -90.37 132.78 35.4 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 114.01 1.115 . . . . 0.0 114.01 175.233 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -67.36 128.45 36.44 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-O 121.588 0.709 . . . . 0.0 112.186 -176.655 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 1.7 p -107.19 -3.64 19.62 Favored 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 116.743 2.127 . . . . 0.0 116.743 -177.647 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 34.9 t0 -143.87 165.78 26.77 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 124.799 1.24 . . . . 0.0 108.984 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 1.5 t -55.83 -35.51 66.46 Favored 'General case' 0 N--CA 1.464 0.271 0 N-CA-C 114.673 1.36 . . . . 0.0 114.673 167.081 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 90.2 m-20 -68.06 -22.71 64.93 Favored 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 117.093 2.257 . . . . 0.0 117.093 176.25 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -88.2 144.8 26.24 Favored 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 115.398 1.629 . . . . 0.0 115.398 -163.137 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -90.28 139.89 30.22 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 127.326 2.25 . . . . 0.0 109.82 177.552 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 15.9 tt0 -91.63 131.13 37.25 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.801 0.84 . . . . 0.0 110.559 171.393 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 80.5 mt -124.89 136.94 54.25 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 124.998 1.319 . . . . 0.0 111.961 -179.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 3.3 tppp? -96.27 141.72 29.27 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 125.873 1.669 . . . . 0.0 110.495 163.614 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -57.25 107.73 0.45 Allowed 'General case' 0 CA--C 1.545 0.752 0 CA-C-N 119.281 0.946 . . . . 0.0 109.907 170.163 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 122.46 -11.06 9.11 Favored Glycine 0 CA--C 1.537 1.437 0 C-N-CA 126.546 2.022 . . . . 0.0 114.592 -172.191 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 74.6 m-20 -71.85 124.86 25.75 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 119.835 1.818 . . . . 0.0 115.72 -178.029 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 16.7 t -74.89 133.25 31.88 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 C-N-CA 123.232 0.613 . . . . 0.0 110.369 164.382 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -125.48 122.15 61.92 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.443 0 C-N-CA 125.011 1.324 . . . . 0.0 111.136 175.84 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 548' ' ' LEU . . . . . 0.475 ' CD2' ' HE2' ' A' ' 524' ' ' LYS . 20.8 mt -79.93 103.45 9.82 Favored 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 108.149 -1.056 . . . . 0.0 108.149 177.643 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 549' ' ' VAL . . . . . . . . . . . . . 4.0 t -62.32 126.32 20.33 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.083 0 N-CA-C 113.499 0.926 . . . . 0.0 113.499 172.204 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 20.5 pt -126.43 159.8 61.23 Favored Pre-proline 0 N--CA 1.474 0.744 0 C-N-CA 126.978 2.111 . . . . 0.0 108.94 179.219 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo -72.54 149.74 50.14 Favored 'Trans proline' 0 N--CA 1.456 -0.711 0 C-N-CA 122.948 2.432 . . . . 0.0 112.303 175.362 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 72.0 m-85 -64.28 147.53 52.26 Favored 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 113.526 0.936 . . . . 0.0 113.526 167.775 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 553' ' ' GLN . . . . . . . . . . . . . 11.7 pm0 -67.17 -19.89 65.65 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.386 1.475 . . . . 0.0 114.069 170.017 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 7.0 m-20 -151.78 147.13 19.51 Favored Pre-proline 0 CA--C 1.543 0.688 0 C-N-CA 125.447 1.499 . . . . 0.0 112.506 179.883 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 555' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -68.46 -31.53 27.32 Favored 'Trans proline' 0 CA--C 1.535 0.568 0 C-N-CA 124.096 3.197 . . . . 0.0 112.329 175.439 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -77.73 -11.7 59.9 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.756 1.623 . . . . 0.0 114.065 177.467 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 557' ' ' GLU . . . . . . . . . . . . . 23.9 mm-40 -75.0 -33.09 61.78 Favored 'General case' 0 N--CA 1.476 0.868 0 O-C-N 120.986 -1.071 . . . . 0.0 112.721 165.884 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 54.6 tt0 -66.36 128.26 35.48 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 124.373 1.069 . . . . 0.0 112.62 -168.466 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 72.5 m-20 -103.99 145.72 29.74 Favored 'General case' 0 CA--C 1.554 1.135 0 C-N-CA 125.684 1.594 . . . . 0.0 113.066 -176.937 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 72.5 tt0 -76.87 107.53 9.26 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 124.786 1.234 . . . . 0.0 112.938 -169.406 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 96.11 1.29 61.27 Favored Glycine 0 CA--C 1.537 1.419 0 C-N-CA 125.072 1.32 . . . . 0.0 114.392 -174.745 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 53.5 m95 -93.53 169.48 10.31 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 126.344 1.857 . . . . 0.0 113.31 176.67 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 16.6 mt -141.38 153.22 44.95 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 125.488 1.515 . . . . 0.0 110.39 165.787 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 57.5 ttm -105.25 142.52 34.87 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 125.396 1.479 . . . . 0.0 112.262 170.575 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -165.24 -174.83 35.31 Favored Glycine 0 CA--C 1.527 0.788 0 C-N-CA 124.946 1.26 . . . . 0.0 112.795 174.566 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 12.7 p -128.92 139.99 50.43 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 C-N-CA 125.127 1.371 . . . . 0.0 109.321 169.777 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 34.9 mtmt -58.02 135.59 56.99 Favored 'General case' 0 N--CA 1.468 0.435 0 O-C-N 121.538 -0.726 . . . . 0.0 110.814 175.407 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -59.22 -38.88 81.05 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-O 118.159 -0.924 . . . . 0.0 111.215 176.768 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 8.7 t -71.77 -32.65 67.9 Favored 'General case' 0 N--CA 1.477 0.89 0 CA-C-N 119.912 1.233 . . . . 0.0 111.782 -179.175 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 71.2 m-20 -61.59 -50.19 73.62 Favored 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 113.669 0.989 . . . . 0.0 113.669 167.751 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 49.8 t-105 -68.04 -33.36 74.42 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 114.305 1.224 . . . . 0.0 114.305 -179.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 8.4 t-20 -68.17 -30.16 69.2 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.591 1.157 . . . . 0.0 111.919 178.292 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 41.6 mt-30 -78.3 3.47 15.42 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.489 1.116 . . . . 0.0 112.984 170.764 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 26.0 m-70 61.15 31.46 19.63 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 126.538 1.935 . . . . 0.0 112.897 179.573 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 20.9 mttm -65.11 154.7 37.15 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 123.883 0.873 . . . . 0.0 112.807 179.819 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 576' ' ' GLU . . . . . 0.414 ' HG2' ' HG ' ' A' ' 580' ' ' CYS . 9.1 pm0 -53.18 104.74 0.1 Allowed 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 126.152 1.781 . . . . 0.0 112.892 179.573 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 58.2 tp -64.02 -50.08 69.85 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 124.488 1.115 . . . . 0.0 111.917 -166.299 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 16.1 pm0 -61.39 -22.8 65.31 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.285 1.034 . . . . 0.0 113.778 -178.149 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 23.4 tptm -88.46 -55.27 3.79 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 126.062 1.745 . . . . 0.0 111.195 175.124 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 580' ' ' CYS . . . . . 0.414 ' HG ' ' HG2' ' A' ' 576' ' ' GLU . 87.8 m -75.0 -19.63 60.0 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 125.155 1.382 . . . . 0.0 114.694 -168.98 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 19.9 ptt180 -64.03 160.47 17.94 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 123.649 0.78 . . . . 0.0 111.61 170.202 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -166.21 172.33 41.5 Favored Glycine 0 CA--C 1.525 0.709 0 CA-C-N 115.142 -0.936 . . . . 0.0 113.158 173.302 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 22.7 m -91.61 145.53 7.39 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.34 0 C-N-CA 124.427 1.091 . . . . 0.0 111.245 168.853 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 47.4 p90 -140.57 155.5 69.63 Favored Pre-proline 0 C--O 1.24 0.6 0 C-N-CA 124.82 1.248 . . . . 0.0 112.664 176.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -67.95 109.41 1.92 Allowed 'Trans proline' 0 N--CA 1.457 -0.623 0 C-N-CA 122.0 1.8 . . . . 0.0 109.62 170.503 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 19.2 pt-20 -54.47 -28.02 41.68 Favored 'General case' 0 N--CA 1.476 0.844 0 O-C-N 121.215 -0.928 . . . . 0.0 112.386 -179.627 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 11.6 p-10 -69.07 -13.59 62.53 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 126.143 1.777 . . . . 0.0 114.361 177.554 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 15.0 m-85 -74.39 -12.83 60.62 Favored 'General case' 0 N--CA 1.467 0.382 0 N-CA-C 116.802 2.149 . . . . 0.0 116.802 163.561 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 589' ' ' THR . . . . . . . . . . . . . 73.4 p -123.99 173.99 7.88 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 125.404 1.482 . . . . 0.0 111.679 -172.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -119.89 140.99 50.0 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.746 1.218 . . . . 0.0 108.942 169.726 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 15.0 tpt180 -67.44 105.72 1.9 Allowed 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.496 1.119 . . . . 0.0 108.959 171.545 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 592' ' ' VAL . . . . . . . . . . . . . 2.1 m -83.83 156.65 64.36 Favored Pre-proline 0 CA--C 1.541 0.633 0 C-N-CA 123.637 0.775 . . . . 0.0 109.275 178.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 593' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_exo . . . . . 0 C--O 1.255 1.368 1 C-N-CA 126.398 4.732 . . . . 0.0 115.654 172.355 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B 1728 ' ' SER . . . . . . . . . . . . . 3.3 m . . . . . 0 N--CA 1.477 0.886 0 N-CA-C 113.046 0.758 . . . . 0.0 113.046 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B 1729 ' ' THR . . . . . . . . . . . . 0.257 0.2 OUTLIER -118.21 -20.86 8.43 Favored 'General case' 0 N--CA 1.481 1.08 0 N-CA-C 117.166 2.284 . . . . 0.0 117.166 -170.445 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B 1730 ' ' VAL . . . . . . . . . . . . . 12.6 m -69.76 150.27 96.62 Favored Pre-proline 0 N--CA 1.476 0.837 0 C-N-CA 125.119 1.368 . . . . 0.0 112.824 175.556 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -67.46 165.04 28.51 Favored 'Trans proline' 0 CA--C 1.542 0.912 0 C-N-CA 123.947 3.098 . . . . 0.0 114.039 179.896 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 29.7 t -133.85 131.51 56.35 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 125.63 1.572 . . . . 0.0 111.429 -179.622 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -65.62 139.47 97.11 Favored Pre-proline 0 CA--C 1.552 1.039 0 O-C-N 121.439 -0.788 . . . . 0.0 112.361 -179.047 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo -75.13 164.94 32.15 Favored 'Trans proline' 0 CA--C 1.547 1.152 0 C-N-CA 123.186 2.59 . . . . 0.0 112.62 175.709 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -58.55 159.86 18.85 Favored 'Trans proline' 0 CA--C 1.541 0.86 0 C-N-CA 123.67 2.913 . . . . 0.0 114.223 174.888 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B 1736 ' ' ARG . . . . . . . . . . . . . 51.3 mtp180 -127.35 164.24 22.25 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 126.04 1.736 . . . . 0.0 111.715 173.605 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B 1737 ' ' ARG . . . . . . . . . . . . . 35.7 ptt180 -143.47 158.71 43.43 Favored 'General case' 0 N--CA 1.48 1.042 0 N-CA-C 114.529 1.307 . . . . 0.0 114.529 -159.371 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B 1738 ' ' ARG . . . . . . . . . . . . . 26.0 mtp-105 -52.9 148.96 6.88 Favored 'General case' 0 N--CA 1.476 0.836 0 N-CA-C 115.09 1.515 . . . . 0.0 115.09 -179.668 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B 1739 ' ' ARG . . . . . . . . . . . . . 18.4 ttp85 -93.01 151.23 20.02 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 125.654 1.582 . . . . 0.0 109.004 155.604 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B 1740 ' ' GLY . . . . . . . . . . . . . . . 83.89 173.83 49.99 Favored Glycine 0 CA--C 1.536 1.361 0 N-CA-C 110.645 -0.982 . . . . 0.0 110.645 -152.012 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B 1741 ' ' ARG . . . . . . . . . . . . . 47.5 ptt85 -69.92 134.62 48.61 Favored 'General case' 0 N--CA 1.48 1.052 0 CA-C-N 118.789 1.295 . . . . 0.0 113.435 -170.788 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B 1742 ' ' ASN . . . . . . . . . . . . . 15.5 m120 -88.32 62.73 6.81 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 126.123 1.769 . . . . 0.0 109.829 -176.174 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B 1743 ' ' LEU . . . . . . . . . . . . . 1.8 pt? -66.94 133.96 51.04 Favored 'General case' 0 CA--C 1.537 0.479 0 N-CA-C 114.016 1.117 . . . . 0.0 114.016 -166.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B 1744 ' ' THR . . . . . . . . . . . . . 7.8 t . . . . . 0 C--O 1.257 1.46 0 C-N-CA 126.857 2.063 . . . . 0.0 111.692 174.904 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 513' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 1.017 0 N-CA-C 110.519 -1.033 . . . . 0.0 110.519 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 514' ' ' ARG . . . . . . . . . . . . . 16.2 ptt85 -79.66 145.52 32.97 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 113.116 0.784 . . . . 0.0 113.116 -174.802 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 51.2 tp -78.61 -34.97 46.27 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.442 1.497 . . . . 0.0 113.765 -178.346 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 516' ' ' ASP . . . . . . . . . . . . . 31.8 t0 -64.61 148.36 51.04 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 123.809 0.843 . . . . 0.0 111.973 -172.288 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 14.1 mt -131.65 159.83 70.15 Favored Pre-proline 0 CA--C 1.545 0.77 0 C-N-CA 126.691 1.996 . . . . 0.0 111.818 -169.406 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -68.45 159.26 54.18 Favored 'Trans proline' 0 CA--C 1.539 0.771 0 C-N-CA 123.957 3.105 . . . . 0.0 113.38 -172.734 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -61.89 128.42 24.24 Favored 'Trans proline' 0 N--CA 1.459 -0.536 0 C-N-CA 123.218 2.612 . . . . 0.0 111.321 -174.759 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 73.48 5.47 67.85 Favored Glycine 0 CA--C 1.537 1.446 0 CA-C-O 116.865 -2.075 . . . . 0.0 115.805 -177.177 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 22.2 t80 -35.67 133.96 0.37 Allowed 'General case' 0 N--CA 1.471 0.608 0 CA-C-N 120.508 2.154 . . . . 0.0 116.52 177.254 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 53.3 mtm -107.08 -57.45 2.07 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 123.541 0.736 . . . . 0.0 111.701 -177.301 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 523' ' ' PHE . . . . . . . . . . . . . 25.8 p90 -160.25 169.66 22.75 Favored 'General case' 0 C--O 1.222 -0.366 0 C-N-CA 125.168 1.387 . . . . 0.0 114.142 -174.571 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 524' ' ' LYS . . . . . 0.424 ' HE2' ' CD2' ' A' ' 548' ' ' LEU . 85.3 mttt -102.6 164.19 11.79 Favored 'General case' 0 CA--C 1.538 0.485 0 O-C-N 121.118 -0.989 . . . . 0.0 112.272 168.056 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 10.2 m -136.32 159.49 38.34 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 C-N-CA 127.051 2.14 . . . . 0.0 109.546 165.109 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 45.0 tt0 -123.58 128.57 49.89 Favored 'General case' 0 N--CA 1.475 0.779 0 CA-C-N 119.323 0.965 . . . . 0.0 112.213 168.755 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 527' ' ' ALA . . . . . . . . . . . . . . . -64.03 122.61 16.95 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.103 0.961 . . . . 0.0 112.313 -179.275 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 48.5 mm-40 -88.23 -23.18 23.61 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.497 1.519 . . . . 0.0 111.867 174.514 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 93.8 m-70 -139.65 157.74 45.27 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 126.984 2.114 . . . . 0.0 110.206 -175.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 34.8 p-10 -87.19 135.65 33.22 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 119.374 0.988 . . . . 0.0 113.22 -179.503 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 83.0 t80 -128.63 110.03 11.87 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 124.6 1.16 . . . . 0.0 111.829 -178.332 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 532' ' ' THR . . . . . . . . . . . . 0.253 0.2 OUTLIER -82.91 113.91 20.84 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 114.148 1.166 . . . . 0.0 114.148 168.677 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -62.02 143.73 56.16 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 123.858 0.863 . . . . 0.0 112.186 175.43 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 534' ' ' THR . . . . . . . . . . . . 0.27 4.6 t -126.23 21.96 7.27 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 127.233 2.213 . . . . 0.0 114.36 179.496 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 38.7 t0 -152.63 156.24 38.88 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 107.565 -1.272 . . . . 0.0 107.565 165.764 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 5.0 t -68.17 -10.39 53.92 Favored 'General case' 0 N--CA 1.476 0.86 0 N-CA-C 114.956 1.465 . . . . 0.0 114.956 167.33 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 39.7 t0 -77.55 -31.03 53.02 Favored 'General case' 0 CA--C 1.553 1.07 0 C-N-CA 125.506 1.523 . . . . 0.0 110.989 167.037 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 82.8 mt-10 -81.52 147.16 29.81 Favored 'General case' 0 CA--C 1.547 0.835 0 O-C-N 120.265 -1.522 . . . . 0.0 113.67 -175.779 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -93.14 139.04 31.01 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 127.068 2.147 . . . . 0.0 110.31 176.027 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 15.6 tt0 -94.72 129.91 41.44 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.408 1.083 . . . . 0.0 111.574 179.423 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 76.7 mt -128.56 148.7 50.78 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.699 1.2 . . . . 0.0 112.86 -176.023 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 12.5 tmtt? -120.41 148.13 44.17 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 126.32 1.848 . . . . 0.0 109.841 169.766 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -56.29 99.5 0.03 OUTLIER 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 123.735 0.814 . . . . 0.0 111.856 174.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 127.73 -4.59 7.03 Favored Glycine 0 CA--C 1.537 1.456 0 C-N-CA 126.659 2.076 . . . . 0.0 114.304 -176.282 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 81.6 m-20 -79.33 120.88 24.4 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 119.395 1.597 . . . . 0.0 113.648 -176.018 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 36.6 t -74.49 135.01 28.33 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 CA-C-N 119.138 0.881 . . . . 0.0 110.15 168.695 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -123.1 122.21 64.96 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.508 0 C-N-CA 125.651 1.58 . . . . 0.0 111.496 174.549 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 548' ' ' LEU . . . . . 0.424 ' CD2' ' HE2' ' A' ' 524' ' ' LYS . 42.4 mt -78.44 101.2 7.18 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.457 1.103 . . . . 0.0 108.318 175.279 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 549' ' ' VAL . . . . . . . . . . . . . 4.4 t -63.97 131.49 29.62 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.337 0 N-CA-C 114.844 1.424 . . . . 0.0 114.844 173.313 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 15.8 pt -131.93 154.76 81.84 Favored Pre-proline 0 CA--C 1.548 0.903 0 C-N-CA 126.383 1.873 . . . . 0.0 111.28 -178.78 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -72.81 149.18 47.56 Favored 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 124.321 3.347 . . . . 0.0 111.785 173.597 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 63.6 m-85 -71.15 142.09 50.72 Favored 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 114.897 1.443 . . . . 0.0 114.897 -178.656 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 553' ' ' GLN . . . . . 0.493 ' CD ' ' H ' ' A' ' 553' ' ' GLN . 0.0 OUTLIER -71.05 -19.09 62.53 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 127.797 2.439 . . . . 0.0 114.302 169.072 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 17.7 m-20 -142.78 157.95 60.55 Favored Pre-proline 0 CA--C 1.542 0.667 0 C-N-CA 125.869 1.668 . . . . 0.0 112.658 -172.454 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 555' ' ' PRO . . . . . . . . . . . . . 95.0 Cg_endo -73.0 -43.4 0.76 Allowed 'Trans proline' 0 CA--C 1.54 0.822 0 C-N-CA 122.934 2.423 . . . . 0.0 110.998 159.834 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -71.65 -12.73 61.48 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 114.925 1.454 . . . . 0.0 114.925 -170.915 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 557' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -90.82 -19.4 23.47 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.263 1.425 . . . . 0.0 113.041 176.265 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 39.9 tt0 -87.1 114.32 23.61 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.8 1.24 . . . . 0.0 114.152 -176.435 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 54.5 m-20 -93.36 150.25 20.61 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 126.183 1.793 . . . . 0.0 111.726 174.677 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 30.7 tp10 -80.8 127.99 33.15 Favored 'General case' 0 N--CA 1.474 0.726 0 O-C-N 120.968 -1.083 . . . . 0.0 110.895 -177.334 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 83.88 4.9 88.4 Favored Glycine 0 CA--C 1.538 1.501 0 O-C-N 121.327 -0.858 . . . . 0.0 114.705 -173.153 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 562' ' ' TRP . . . . . 0.448 ' CZ2' ' HD3' ' B' 1736 ' ' ARG . 50.2 m95 -110.74 157.38 19.83 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 127.019 2.128 . . . . 0.0 112.598 178.401 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 11.5 mt -133.15 153.74 51.25 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 123.286 0.634 . . . . 0.0 110.992 173.564 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 41.9 ttm -106.37 142.76 35.51 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 123.997 0.919 . . . . 0.0 112.136 177.123 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -165.25 -170.34 30.07 Favored Glycine 0 CA--C 1.525 0.697 0 C-N-CA 124.282 0.944 . . . . 0.0 112.309 173.69 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 14.3 p -134.41 140.7 45.34 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.502 0 C-N-CA 125.966 1.707 . . . . 0.0 108.993 170.884 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 41.7 mtmt -62.42 134.76 56.89 Favored 'General case' 0 N--CA 1.465 0.304 0 O-C-N 121.139 -0.976 . . . . 0.0 112.064 176.636 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -57.36 -43.06 83.2 Favored 'General case' 0 C--O 1.222 -0.375 0 CA-C-O 118.12 -0.943 . . . . 0.0 111.391 -177.006 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 33.2 t -62.62 -33.1 74.32 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 119.358 0.981 . . . . 0.0 113.529 -178.849 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -69.69 -45.95 67.12 Favored 'General case' 0 CA--C 1.542 0.672 0 O-C-N 120.835 -1.166 . . . . 0.0 108.812 176.19 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 66.1 t-105 -66.72 -36.3 82.16 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 124.329 1.052 . . . . 0.0 112.525 179.49 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -67.78 -31.27 71.04 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 126.288 1.835 . . . . 0.0 111.783 175.213 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 44.1 mt-30 -77.09 -0.63 25.48 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.609 1.164 . . . . 0.0 113.73 172.287 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 67.0 m-70 68.37 18.85 9.05 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 127.99 2.516 . . . . 0.0 115.119 -178.406 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 6.7 mtpm? -76.34 160.71 29.35 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 125.233 1.413 . . . . 0.0 112.987 -173.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 18.1 pm0 -58.72 127.29 31.43 Favored 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 114.189 1.181 . . . . 0.0 114.189 -175.059 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 62.0 tp -75.31 -45.81 37.3 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 125.405 1.482 . . . . 0.0 111.891 -173.622 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 23.9 pt-20 -62.81 -18.33 62.61 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 113.856 1.058 . . . . 0.0 113.856 -174.506 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 4.2 tppp? -95.07 -41.57 9.05 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 126.065 1.746 . . . . 0.0 113.715 176.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 48.3 t -78.25 -28.18 47.7 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 118.568 0.622 . . . . 0.0 112.479 -179.796 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 50.7 ptt85 -54.08 149.47 9.35 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-O 121.74 0.781 . . . . 0.0 112.382 -179.74 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -172.47 170.73 43.77 Favored Glycine 0 N--CA 1.462 0.427 0 CA-C-N 115.358 -0.837 . . . . 0.0 114.348 177.025 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 17.6 m -91.91 136.78 23.59 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.252 0 C-N-CA 124.782 1.233 . . . . 0.0 111.43 171.854 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 44.6 p90 -132.57 154.79 81.65 Favored Pre-proline 0 CA--C 1.539 0.536 0 C-N-CA 124.358 1.063 . . . . 0.0 112.968 175.711 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -68.46 110.78 2.36 Favored 'Trans proline' 0 N--CA 1.457 -0.655 0 C-N-CA 122.262 1.975 . . . . 0.0 110.02 169.702 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 21.3 pt-20 -55.79 -29.49 59.77 Favored 'General case' 0 CA--C 1.547 0.855 0 O-C-N 121.416 -0.802 . . . . 0.0 112.233 -179.832 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 9.7 p-10 -67.22 -8.7 33.55 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 126.141 1.776 . . . . 0.0 114.523 179.446 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 17.1 m-85 -82.68 -11.9 58.0 Favored 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 116.783 2.142 . . . . 0.0 116.783 166.622 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 589' ' ' THR . . . . . . . . . . . . . 60.4 p -122.77 173.23 7.88 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 125.511 1.525 . . . . 0.0 111.528 -171.881 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -124.14 139.45 53.91 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.061 0.945 . . . . 0.0 108.997 170.13 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.82 136.23 57.25 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 125.149 1.379 . . . . 0.0 109.127 177.225 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 592' ' ' VAL . . . . . . . . . . . . . 2.4 m -126.87 155.57 75.27 Favored Pre-proline 0 N--CA 1.481 1.115 0 C-N-CA 124.78 1.232 . . . . 0.0 109.486 177.783 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 593' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo . . . . . 0 C--O 1.253 1.242 0 C-N-CA 124.325 3.35 . . . . 0.0 114.527 -170.825 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B 1728 ' ' SER . . . . . . . . . . . . . 89.4 p . . . . . 0 N--CA 1.472 0.658 0 CA-C-O 121.253 0.549 . . . . 0.0 110.803 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B 1729 ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -82.38 7.98 12.65 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 127.546 2.339 . . . . 0.0 117.118 -168.837 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B 1730 ' ' VAL . . . . . . . . . . . . . 16.6 m -62.67 151.56 83.87 Favored Pre-proline 0 CA--C 1.547 0.848 0 C-N-CA 126.075 1.75 . . . . 0.0 113.302 179.329 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -69.17 169.68 17.6 Favored 'Trans proline' 0 CA--C 1.542 0.879 0 C-N-CA 123.758 2.972 . . . . 0.0 112.966 175.757 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 2.9 t -132.49 138.86 51.24 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 C-N-CA 125.777 1.631 . . . . 0.0 112.96 178.869 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -72.63 139.7 80.99 Favored Pre-proline 0 CA--C 1.555 1.135 0 O-C-N 120.763 -1.211 . . . . 0.0 112.759 -176.558 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo -76.23 165.45 29.45 Favored 'Trans proline' 0 CA--C 1.553 1.428 0 C-N-CA 123.049 2.5 . . . . 0.0 114.181 -177.442 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 34.5 Cg_exo -64.66 154.3 73.03 Favored 'Trans proline' 0 C--N 1.351 0.703 0 C-N-CA 123.999 3.133 . . . . 0.0 114.207 179.723 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B 1736 ' ' ARG . . . . . 0.448 ' HD3' ' CZ2' ' A' ' 562' ' ' TRP . 16.1 mtm180 -124.07 167.82 13.7 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 124.98 1.312 . . . . 0.0 112.616 -173.206 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B 1737 ' ' ARG . . . . . . . . . . . . . 65.8 mtt-85 -106.93 156.82 18.3 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 125.904 1.681 . . . . 0.0 114.723 -170.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B 1738 ' ' ARG . . . . . . . . . . . . . 13.0 tpt180 -67.77 116.15 8.12 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 124.632 1.173 . . . . 0.0 111.136 175.679 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B 1739 ' ' ARG . . . . . . . . . . . . . 14.5 ttp85 -80.77 144.68 31.95 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 124.166 0.986 . . . . 0.0 111.066 171.044 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B 1740 ' ' GLY . . . . . . . . . . . . . . . 64.77 -156.14 47.18 Favored Glycine 0 CA--C 1.53 1.029 0 C-N-CA 123.422 0.534 . . . . 0.0 113.43 -168.098 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B 1741 ' ' ARG . . . . . . . . . . . . . 17.6 tpp180 -111.2 138.54 47.52 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.334 1.054 . . . . 0.0 111.16 -178.77 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B 1742 ' ' ASN . . . . . . . . . . . . . 46.3 p-10 -57.88 19.83 0.0 OUTLIER 'General case' 0 CA--C 1.554 1.116 0 C-N-CA 129.091 2.956 . . . . 0.0 117.493 172.11 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B 1743 ' ' LEU . . . . . . . . . . . . . 65.0 tp -55.28 -55.59 29.67 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 125.404 1.482 . . . . 0.0 112.815 -171.476 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B 1744 ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.255 1.395 0 N-CA-C 116.754 2.131 . . . . 0.0 116.754 177.103 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 513' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.215 0 N-CA-C 112.422 -0.271 . . . . 0.0 112.422 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 514' ' ' ARG . . . . . . . . . . . . . 6.7 ppt_? -65.25 169.92 5.2 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 127.477 2.311 . . . . 0.0 115.809 -175.16 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 83.6 mt -84.83 -74.24 0.4 Allowed 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 125.119 1.368 . . . . 0.0 110.668 168.249 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 516' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -117.44 154.69 30.95 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 116.846 2.165 . . . . 0.0 116.846 -175.034 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 14.9 mt -65.36 163.56 31.5 Favored Pre-proline 0 CA--C 1.551 0.992 0 C-N-CA 125.852 1.661 . . . . 0.0 112.605 166.348 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_endo -67.8 162.14 40.86 Favored 'Trans proline' 0 CA--C 1.539 0.775 0 C-N-CA 123.755 2.97 . . . . 0.0 114.055 -176.056 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -64.11 138.67 63.0 Favored 'Trans proline' 0 C--N 1.348 0.546 0 C-N-CA 122.78 2.32 . . . . 0.0 109.89 176.348 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 70.58 4.72 53.69 Favored Glycine 0 CA--C 1.532 1.114 0 CA-C-O 117.638 -1.646 . . . . 0.0 115.69 -176.016 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 48.8 t80 -44.72 129.87 7.03 Favored 'General case' 0 C--O 1.238 0.494 0 CA-C-N 120.82 2.31 . . . . 0.0 115.216 179.697 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 60.1 mtm -105.36 -59.09 1.81 Allowed 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 123.883 0.873 . . . . 0.0 111.932 -179.151 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 523' ' ' PHE . . . . . 0.525 ' CD1' ' HD3' ' A' ' 591' ' ' ARG . 32.5 p90 -160.34 175.45 12.82 Favored 'General case' 0 C--O 1.224 -0.252 0 C-N-CA 126.155 1.782 . . . . 0.0 112.406 -175.555 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 81.3 mttt -106.51 164.09 12.34 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 121.023 -1.048 . . . . 0.0 112.65 171.332 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 12.0 m -131.62 160.94 42.02 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 C-N-CA 126.145 1.778 . . . . 0.0 109.552 164.377 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 45.2 tt0 -122.19 128.03 50.72 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 118.613 0.642 . . . . 0.0 111.423 166.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 527' ' ' ALA . . . . . . . . . . . . . . . -56.63 123.35 14.55 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.241 1.016 . . . . 0.0 111.209 173.049 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 42.3 mm-40 -84.84 -27.45 26.74 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.153 1.381 . . . . 0.0 110.91 168.596 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 88.0 m-70 -139.34 160.18 40.43 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 127.065 2.146 . . . . 0.0 111.657 -174.23 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . 0.314 1.6 p30 -84.19 138.2 33.11 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 115.713 1.746 . . . . 0.0 115.713 178.932 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 89.3 t80 -138.25 128.33 25.69 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.609 1.564 . . . . 0.0 114.298 -176.147 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -90.8 128.2 36.62 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 124.7 1.2 . . . . 0.0 114.189 175.03 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -69.99 121.78 18.07 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 119.161 0.891 . . . . 0.0 110.822 173.032 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 12.2 t -88.51 -20.55 24.97 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 115.049 1.5 . . . . 0.0 115.049 -177.766 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 18.8 m-20 -145.18 177.5 8.75 Favored 'General case' 0 CA--C 1.554 1.11 0 N-CA-C 116.872 2.175 . . . . 0.0 116.872 -165.856 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 5.3 t -59.37 -17.81 33.28 Favored 'General case' 0 N--CA 1.481 1.09 0 N-CA-C 119.141 3.015 . . . . 0.0 119.141 -173.67 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . 0.287 18.8 m-20 -129.14 16.73 6.14 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 125.9 1.68 . . . . 0.0 115.18 175.776 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 20.0 mp0 -95.67 145.0 25.61 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.947 1.299 . . . . 0.0 112.797 -174.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -99.61 128.72 45.72 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 125.194 1.398 . . . . 0.0 111.538 -172.979 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 38.0 tt0 -84.64 124.95 32.04 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 124.843 1.257 . . . . 0.0 110.396 176.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 79.9 mt -125.12 145.99 49.68 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 124.925 1.29 . . . . 0.0 112.275 -178.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -115.11 143.73 44.75 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 125.817 1.647 . . . . 0.0 109.367 168.829 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -55.72 110.12 0.67 Allowed 'General case' 0 CA--C 1.545 0.777 0 CA-C-N 118.503 0.592 . . . . 0.0 110.705 179.736 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 115.78 -5.58 20.54 Favored Glycine 0 CA--C 1.538 1.488 0 C-N-CA 126.415 1.96 . . . . 0.0 114.618 -174.796 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 83.2 m-20 -72.82 124.64 25.79 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 115.794 1.775 . . . . 0.0 115.794 -176.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 41.7 t -72.84 133.71 31.22 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 C-N-CA 123.68 0.792 . . . . 0.0 110.156 169.116 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 1.5 t -128.07 123.66 60.99 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.328 0 C-N-CA 124.57 1.148 . . . . 0.0 111.527 174.301 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 30.1 mt -79.98 100.47 8.14 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.004 1.322 . . . . 0.0 108.55 177.465 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 549' ' ' VAL . . . . . . . . . . . . . 7.1 t -61.1 132.14 26.46 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.267 0 N-CA-C 114.924 1.453 . . . . 0.0 114.924 173.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 20.9 pt -129.99 157.45 76.9 Favored Pre-proline 0 CA--C 1.551 0.981 0 C-N-CA 127.098 2.159 . . . . 0.0 109.873 174.924 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -73.66 154.69 49.56 Favored 'Trans proline' 0 CA--C 1.536 0.601 0 C-N-CA 124.021 3.147 . . . . 0.0 112.094 174.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 36.8 m-85 -66.72 149.01 51.14 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 117.195 2.294 . . . . 0.0 117.195 176.395 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 553' ' ' GLN . . . . . . . . . . . . . 6.3 pt20 -70.2 -22.12 62.96 Favored 'General case' 0 N--CA 1.475 0.775 0 N-CA-C 114.243 1.201 . . . . 0.0 114.243 174.562 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 -147.6 146.26 24.0 Favored Pre-proline 0 CA--C 1.54 0.585 0 C-N-CA 125.865 1.666 . . . . 0.0 109.741 170.343 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 555' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -65.57 -35.4 38.3 Favored 'Trans proline' 0 CA--C 1.536 0.604 0 C-N-CA 123.027 2.484 . . . . 0.0 110.831 172.762 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 24.4 pt-20 -72.88 -7.7 52.13 Favored 'General case' 0 CA--C 1.547 0.848 0 N-CA-C 114.492 1.293 . . . . 0.0 114.492 177.237 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 557' ' ' GLU . . . . . . . . . . . . . 21.9 mm-40 -86.58 -23.37 25.8 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 124.787 1.235 . . . . 0.0 113.138 165.892 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -73.76 123.9 25.03 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 123.91 0.884 . . . . 0.0 113.375 -172.252 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . 0.292 18.5 m-20 -96.6 140.03 31.81 Favored 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 116.554 2.057 . . . . 0.0 116.554 -179.175 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 54.9 tp10 -73.88 120.81 19.98 Favored 'General case' 0 CA--C 1.539 0.537 0 O-C-N 120.955 -1.091 . . . . 0.0 112.078 -173.563 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 87.82 3.12 80.63 Favored Glycine 0 CA--C 1.536 1.36 0 C-N-CA 124.514 1.054 . . . . 0.0 114.599 -172.68 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 57.1 m95 -100.98 164.52 11.78 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.569 1.548 . . . . 0.0 112.919 176.284 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 11.6 mt -137.77 152.4 49.13 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 124.943 1.297 . . . . 0.0 109.831 168.699 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 52.1 ttm -108.1 141.97 39.0 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 124.306 1.042 . . . . 0.0 111.503 172.516 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -169.85 -171.79 35.74 Favored Glycine 0 CA--C 1.526 0.767 0 C-N-CA 124.543 1.068 . . . . 0.0 112.666 176.188 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 14.7 p -132.65 138.54 51.79 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 C-N-CA 125.66 1.584 . . . . 0.0 108.893 171.085 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 37.9 mtmt -59.09 139.42 56.89 Favored 'General case' 0 N--CA 1.467 0.42 0 O-C-N 121.224 -0.922 . . . . 0.0 111.167 176.052 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 14.1 tt0 -60.0 -43.19 95.37 Favored 'General case' 0 C--O 1.222 -0.379 0 CA-C-O 119.008 -0.52 . . . . 0.0 110.742 176.524 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 76.4 p -60.05 -34.62 73.66 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 114.403 1.26 . . . . 0.0 114.403 176.467 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 40.9 m-20 -71.15 -45.84 62.71 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.281 1.432 . . . . 0.0 113.893 173.719 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 56.6 t-105 -71.46 -34.79 70.54 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 125.065 1.346 . . . . 0.0 113.834 178.332 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 33.6 t-20 -67.61 -21.81 65.39 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 125.586 1.554 . . . . 0.0 111.881 176.747 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 23.6 mm-40 -89.02 6.51 39.36 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.816 1.246 . . . . 0.0 114.279 169.411 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 2.2 m-70 61.92 23.57 13.89 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 125.79 1.636 . . . . 0.0 113.938 171.66 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 19.2 mtpp -74.56 168.48 19.68 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 125.931 1.693 . . . . 0.0 113.016 -175.774 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 8.3 pm0 -56.72 97.66 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.974 1.71 . . . . 0.0 113.327 -176.632 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 60.6 tp -54.23 -43.26 70.7 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.328 1.451 . . . . 0.0 111.906 -173.807 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -63.01 -33.85 76.31 Favored 'General case' 0 N--CA 1.476 0.859 0 N-CA-C 113.131 0.789 . . . . 0.0 113.131 -176.743 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 29.6 mmtp -88.49 -39.05 14.49 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 123.673 0.789 . . . . 0.0 112.511 175.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 93.6 m -71.83 -35.09 69.79 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 113.274 0.842 . . . . 0.0 113.274 -177.176 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.13 169.98 1.83 Allowed 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.174 0.99 . . . . 0.0 112.07 176.918 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -178.78 177.56 48.49 Favored Glycine 0 N--CA 1.45 -0.399 0 CA-C-N 114.606 -1.179 . . . . 0.0 114.414 166.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 19.3 m -88.88 141.61 14.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 C-N-CA 124.66 1.184 . . . . 0.0 111.542 166.227 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 39.8 p90 -136.5 154.06 76.55 Favored Pre-proline 0 CA--C 1.538 0.518 0 C-N-CA 125.395 1.478 . . . . 0.0 112.187 175.149 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -65.9 112.45 2.24 Favored 'Trans proline' 0 N--CA 1.46 -0.479 0 C-N-CA 121.788 1.659 . . . . 0.0 108.898 170.134 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 18.7 pt-20 -56.28 -30.8 62.96 Favored 'General case' 0 N--CA 1.471 0.604 0 O-C-N 121.346 -0.846 . . . . 0.0 111.459 -178.015 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 8.4 p-10 -63.49 -18.16 63.51 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 126.081 1.752 . . . . 0.0 113.914 178.667 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 9.5 m-85 -74.39 -13.97 60.8 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 116.125 1.898 . . . . 0.0 116.125 166.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 589' ' ' THR . . . . . . . . . . . . . 30.9 p -121.76 176.67 5.62 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 127.043 2.137 . . . . 0.0 112.199 -176.682 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 15.8 pt-20 -131.69 138.51 48.73 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.757 1.223 . . . . 0.0 109.808 168.476 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 591' ' ' ARG . . . . . 0.525 ' HD3' ' CD1' ' A' ' 523' ' ' PHE . 4.0 tpt180 -66.1 120.82 13.85 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 125.304 1.442 . . . . 0.0 111.294 176.252 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 592' ' ' VAL . . . . . . . . . . . . . 3.8 m -108.0 154.46 41.12 Favored Pre-proline 0 N--CA 1.477 0.915 0 C-N-CA 125.241 1.416 . . . . 0.0 109.328 -178.154 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 593' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo . . . . . 0 C--O 1.251 1.172 0 C-N-CA 123.635 2.89 . . . . 0.0 113.526 -174.467 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B 1728 ' ' SER . . . . . . . . . . . . . 41.7 t . . . . . 0 N--CA 1.47 0.56 0 N-CA-C 109.484 -0.562 . . . . 0.0 109.484 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B 1729 ' ' THR . . . . . . . . . . . . . 30.6 p -73.23 -10.69 60.03 Favored 'General case' 0 N--CA 1.479 1.014 0 N-CA-C 115.904 1.816 . . . . 0.0 115.904 -171.275 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B 1730 ' ' VAL . . . . . . . . . . . . . 2.9 m -67.61 143.31 96.8 Favored Pre-proline 0 N--CA 1.476 0.856 0 N-CA-C 113.477 0.918 . . . . 0.0 113.477 -179.121 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -73.19 164.75 34.51 Favored 'Trans proline' 0 CA--C 1.54 0.804 0 C-N-CA 123.927 3.085 . . . . 0.0 112.713 174.369 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 31.6 t -129.78 132.38 65.94 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 C-N-CA 125.73 1.612 . . . . 0.0 110.697 176.745 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -67.4 144.97 98.31 Favored Pre-proline 0 CA--C 1.549 0.939 0 N-CA-C 113.077 0.769 . . . . 0.0 113.077 -172.69 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -77.99 168.66 21.72 Favored 'Trans proline' 0 CA--C 1.548 1.183 0 C-N-CA 122.949 2.433 . . . . 0.0 112.391 175.35 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 77.8 Cg_exo -58.46 157.99 24.79 Favored 'Trans proline' 0 CA--C 1.542 0.906 0 C-N-CA 123.719 2.946 . . . . 0.0 114.357 177.247 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B 1736 ' ' ARG . . . . . . . . . . . . . 11.8 mtp-105 -131.31 164.07 26.43 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 126.045 1.738 . . . . 0.0 112.924 174.351 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B 1737 ' ' ARG . . . . . . . . . . . . . 31.5 mtt85 -135.88 -32.75 0.87 Allowed 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 126.604 1.961 . . . . 0.0 111.714 -172.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B 1738 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 58.6 11.25 1.68 Allowed 'General case' 0 N--CA 1.494 1.757 0 C-N-CA 128.106 2.563 . . . . 0.0 116.798 163.231 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B 1739 ' ' ARG . . . . . . . . . . . . . 1.2 tpm_? 54.79 39.23 31.29 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 127.326 2.25 . . . . 0.0 113.348 -162.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B 1740 ' ' GLY . . . . . . . . . . . . . . . -115.07 -167.48 15.4 Favored Glycine 0 CA--C 1.536 1.344 0 C-N-CA 125.794 1.664 . . . . 0.0 112.469 171.828 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B 1741 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.18 86.22 1.9 Allowed 'General case' 0 N--CA 1.476 0.858 0 CA-C-O 122.192 0.996 . . . . 0.0 110.216 173.992 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B 1742 ' ' ASN . . . . . . . . . . . . . 9.9 p-10 -64.38 161.39 17.04 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.4 1.48 . . . . 0.0 113.346 178.402 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B 1743 ' ' LEU . . . . . . . . . . . . . 1.7 pt? -71.3 148.8 46.76 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 122.96 0.504 . . . . 0.0 111.322 158.43 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B 1744 ' ' THR . . . . . . . . . . . . 0.328 0.2 OUTLIER . . . . . 0 N--CA 1.482 1.132 0 N-CA-C 115.983 1.846 . . . . 0.0 115.983 179.796 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 513' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.119 0 N-CA-C 111.918 -0.473 . . . . 0.0 111.918 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 514' ' ' ARG . . . . . . . . . . . . . 2.2 mmp_? -78.65 160.3 27.59 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 125.979 1.712 . . . . 0.0 114.485 -174.08 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -105.23 -40.39 5.87 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 125.248 1.419 . . . . 0.0 111.355 168.254 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 516' ' ' ASP . . . . . . . . . . . . . 39.2 t0 -73.76 133.83 43.35 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 122.682 1.229 . . . . 0.0 108.79 167.398 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 9.3 mt -136.49 159.61 69.91 Favored Pre-proline 0 CA--C 1.541 0.632 0 C-N-CA 125.644 1.578 . . . . 0.0 111.197 -167.231 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 29.9 Cg_endo -67.89 157.44 61.79 Favored 'Trans proline' 0 CA--C 1.541 0.834 0 C-N-CA 123.362 2.708 . . . . 0.0 113.791 -171.209 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_endo -62.46 127.51 21.06 Favored 'Trans proline' 0 N--CA 1.459 -0.551 0 C-N-CA 123.584 2.856 . . . . 0.0 110.074 179.406 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 76.46 1.92 72.5 Favored Glycine 0 CA--C 1.532 1.155 0 CA-C-O 117.616 -1.658 . . . . 0.0 115.785 -175.711 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 30.1 t80 -36.78 128.28 0.85 Allowed 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 116.912 2.19 . . . . 0.0 116.912 178.013 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 52.3 mtm -100.11 -55.1 2.71 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 123.081 0.552 . . . . 0.0 112.178 -178.489 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 523' ' ' PHE . . . . . . . . . . . . . 24.6 p90 -165.62 170.38 14.27 Favored 'General case' 0 C--O 1.222 -0.345 0 C-N-CA 126.323 1.849 . . . . 0.0 112.654 -172.936 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 524' ' ' LYS . . . . . 0.51 ' HE2' ' CD2' ' A' ' 548' ' ' LEU . 78.5 mttt -102.18 162.9 12.56 Favored 'General case' 0 CA--C 1.538 0.483 0 O-C-N 121.169 -0.957 . . . . 0.0 111.807 169.298 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 17.7 m -136.24 160.98 38.08 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.904 0 C-N-CA 127.21 2.204 . . . . 0.0 108.788 166.19 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 41.3 tt0 -126.23 125.99 43.3 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 119.204 0.911 . . . . 0.0 111.587 175.347 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 527' ' ' ALA . . . . . . . . . . . . . . . -58.24 132.84 54.78 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 124.011 0.924 . . . . 0.0 111.391 -179.783 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 84.0 mm-40 -102.46 -23.8 13.89 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 125.941 1.696 . . . . 0.0 112.179 173.201 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 89.9 m-70 -138.13 160.07 40.38 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 126.254 1.822 . . . . 0.0 111.01 -179.05 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -83.1 128.22 34.29 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 125.28 1.432 . . . . 0.0 113.966 -178.912 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 84.9 t80 -130.69 122.65 27.71 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 115.107 1.521 . . . . 0.0 115.107 -176.973 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -95.68 134.77 38.2 Favored 'General case' 0 N--CA 1.48 1.069 0 N-CA-C 115.652 1.723 . . . . 0.0 115.652 174.114 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -74.59 120.51 20.24 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-O 122.12 0.962 . . . . 0.0 112.947 -175.817 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 4.4 t -90.79 6.98 42.05 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 126.836 2.054 . . . . 0.0 115.84 179.894 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -153.23 155.13 36.04 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 129.172 2.989 . . . . 0.0 111.685 -178.61 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 536' ' ' THR . . . . . . . . . . . . 0.264 0.9 OUTLIER -65.38 -25.56 67.62 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 116.124 1.898 . . . . 0.0 116.124 177.16 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 90.2 m-20 -92.74 -8.58 43.39 Favored 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 115.47 1.656 . . . . 0.0 115.47 175.594 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -74.47 146.46 42.77 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.767 1.227 . . . . 0.0 110.909 174.447 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -84.9 159.4 20.34 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 126.398 1.879 . . . . 0.0 110.202 174.637 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 17.8 tt0 -118.84 138.6 52.61 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.454 1.502 . . . . 0.0 110.658 173.844 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 91.3 mt -133.2 141.23 47.98 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 125.082 1.353 . . . . 0.0 111.953 -174.79 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.23 143.28 40.61 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 125.063 1.345 . . . . 0.0 108.507 164.812 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -53.83 117.8 3.46 Favored 'General case' 0 CA--C 1.548 0.894 0 O-C-N 121.633 -0.667 . . . . 0.0 111.94 -179.868 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 110.85 -9.71 29.77 Favored Glycine 0 CA--C 1.532 1.109 0 C-N-CA 126.772 2.13 . . . . 0.0 113.939 -175.347 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 69.0 m-20 -74.83 121.44 21.82 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 118.689 1.245 . . . . 0.0 113.377 -173.881 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 2.7 t -72.31 136.1 26.37 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 O-C-N 121.713 -0.617 . . . . 0.0 112.071 172.393 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -124.08 122.27 63.99 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.6 0 C-N-CA 126.16 1.784 . . . . 0.0 111.428 175.93 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 548' ' ' LEU . . . . . 0.51 ' CD2' ' HE2' ' A' ' 524' ' ' LYS . 20.0 mt -78.37 99.42 6.36 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.637 1.175 . . . . 0.0 108.637 174.983 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 549' ' ' VAL . . . . . . . . . . . . . 6.1 t -60.92 133.12 26.7 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.268 0 N-CA-C 114.583 1.327 . . . . 0.0 114.583 172.984 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 16.8 pt -130.42 156.17 79.95 Favored Pre-proline 0 CA--C 1.55 0.958 0 C-N-CA 126.77 2.028 . . . . 0.0 110.428 177.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 92.3 Cg_endo -72.19 165.55 32.3 Favored 'Trans proline' 0 CA--C 1.536 0.596 0 C-N-CA 124.194 3.263 . . . . 0.0 111.638 173.024 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 66.0 m-85 -85.14 158.79 20.3 Favored 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 116.28 1.956 . . . . 0.0 116.28 -177.692 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 553' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -76.93 -20.3 56.34 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 124.789 1.235 . . . . 0.0 114.03 167.399 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 13.0 m-20 -154.31 149.78 21.05 Favored Pre-proline 0 CA--C 1.539 0.538 0 C-N-CA 124.623 1.169 . . . . 0.0 112.034 173.576 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 555' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -64.92 -29.4 57.99 Favored 'Trans proline' 0 CA--C 1.539 0.773 0 C-N-CA 123.482 2.788 . . . . 0.0 112.569 174.54 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 17.1 pt-20 -82.92 -6.01 59.28 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 125.87 1.668 . . . . 0.0 114.476 171.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 557' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -88.2 -10.21 50.54 Favored 'General case' 0 N--CA 1.478 0.949 0 N-CA-C 114.578 1.325 . . . . 0.0 114.578 167.49 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 4.5 tp60 -82.03 148.97 28.34 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 124.237 1.015 . . . . 0.0 112.072 164.181 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -113.33 141.9 46.49 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 128.146 2.578 . . . . 0.0 113.607 171.169 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 82.5 tt0 -64.42 120.34 12.08 Favored 'General case' 0 N--CA 1.478 0.948 0 O-C-N 119.654 -1.904 . . . . 0.0 112.032 -171.168 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 85.13 5.71 85.42 Favored Glycine 0 CA--C 1.539 1.576 0 C-N-CA 124.897 1.237 . . . . 0.0 115.826 -175.42 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 562' ' ' TRP . . . . . 0.416 ' CZ2' ' HD3' ' B' 1736 ' ' ARG . 41.1 m95 -94.33 173.21 7.75 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 125.386 1.474 . . . . 0.0 113.86 178.396 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 17.3 mt -139.92 154.34 47.21 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 125.137 1.375 . . . . 0.0 110.618 166.704 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 31.4 tpp -107.34 143.33 35.78 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 125.28 1.432 . . . . 0.0 110.932 168.731 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -169.41 -172.42 36.04 Favored Glycine 0 CA--C 1.526 0.742 0 C-N-CA 124.38 0.991 . . . . 0.0 112.607 174.376 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 12.0 p -134.22 140.41 46.13 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.568 0 C-N-CA 125.569 1.548 . . . . 0.0 109.124 173.586 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 35.9 mtmt -56.39 136.16 53.79 Favored 'General case' 0 N--CA 1.468 0.428 0 O-C-N 121.24 -0.913 . . . . 0.0 111.356 176.347 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 52.3 tt0 -61.57 -42.41 98.8 Favored 'General case' 0 C--O 1.22 -0.449 0 CA-C-O 117.868 -1.063 . . . . 0.0 110.71 176.355 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 40.1 t -58.58 -37.2 75.26 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 119.696 1.135 . . . . 0.0 112.501 174.634 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 73.6 m-20 -63.75 -44.27 94.0 Favored 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 114.771 1.397 . . . . 0.0 114.771 172.516 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 55.3 t-105 -75.35 -29.36 59.91 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 124.941 1.296 . . . . 0.0 113.634 177.953 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 5.6 t-20 -68.44 -33.51 74.34 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 126.638 1.975 . . . . 0.0 110.711 172.873 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 30.5 mm100 -79.06 -3.7 46.54 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 124.636 1.174 . . . . 0.0 113.92 167.945 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 574' ' ' HIS . . . . . . . . . . . . 0.283 86.4 m-70 64.13 31.93 13.0 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 127.605 2.362 . . . . 0.0 115.547 168.65 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 78.2 mttt -66.6 170.87 5.69 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 127.566 2.346 . . . . 0.0 114.108 -178.225 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 21.4 pt-20 -59.95 104.65 0.32 Allowed 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 124.629 1.172 . . . . 0.0 113.031 171.738 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 57.7 tp -55.74 -42.84 75.98 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 124.226 1.01 . . . . 0.0 112.421 -171.204 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 2.8 pt-20 -61.86 -30.48 70.88 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 114.73 1.381 . . . . 0.0 114.73 -176.131 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 28.2 mmmt -97.47 -30.68 12.76 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 123.547 0.739 . . . . 0.0 112.819 -179.677 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 32.8 m -70.27 -40.39 74.36 Favored 'General case' 0 CA--C 1.538 0.492 0 N-CA-C 113.507 0.928 . . . . 0.0 113.507 173.141 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 29.6 ptt85 -64.39 161.81 16.26 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 123.867 0.867 . . . . 0.0 112.781 178.374 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -175.44 173.39 46.21 Favored Glycine 0 CA--C 1.52 0.354 0 CA-C-N 115.4 -0.818 . . . . 0.0 114.032 174.15 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 30.1 m -87.87 143.7 10.74 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.274 0 C-N-CA 123.262 0.625 . . . . 0.0 110.199 171.76 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 45.4 p90 -143.55 156.58 60.02 Favored Pre-proline 0 CA--C 1.541 0.629 0 C-N-CA 124.742 1.217 . . . . 0.0 112.346 176.7 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -69.75 111.21 2.75 Favored 'Trans proline' 0 C--N 1.347 0.49 0 C-N-CA 122.291 1.994 . . . . 0.0 109.903 172.762 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 19.6 pt-20 -55.82 -29.71 60.23 Favored 'General case' 0 N--CA 1.475 0.806 0 O-C-N 121.547 -0.721 . . . . 0.0 112.076 -179.07 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 10.9 p-10 -66.32 -20.97 66.24 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 125.604 1.561 . . . . 0.0 114.001 178.612 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 14.0 m-85 -69.07 -14.46 63.03 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 116.717 2.117 . . . . 0.0 116.717 164.605 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 589' ' ' THR . . . . . . . . . . . . . 63.5 p -122.0 173.43 7.54 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 126.277 1.831 . . . . 0.0 111.097 -176.357 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 15.1 pt-20 -126.55 136.34 52.44 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 124.245 1.018 . . . . 0.0 109.001 173.474 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.41 128.22 35.6 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 124.247 1.019 . . . . 0.0 108.692 178.606 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 592' ' ' VAL . . . . . . . . . . . . . 1.9 m -110.76 150.7 42.16 Favored Pre-proline 0 CA--C 1.548 0.886 0 C-N-CA 125.624 1.57 . . . . 0.0 107.666 178.019 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 593' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_exo . . . . . 0 C--O 1.254 1.282 1 C-N-CA 126.52 4.814 . . . . 0.0 116.431 -174.537 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B 1728 ' ' SER . . . . . . . . . . . . . 42.3 t . . . . . 0 N--CA 1.475 0.804 0 CA-C-O 118.052 -0.975 . . . . 0.0 111.859 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B 1729 ' ' THR . . . . . . . . . . . . 0.41 0.3 OUTLIER -125.99 -6.61 6.67 Favored 'General case' 0 N--CA 1.487 1.407 0 N-CA-C 118.139 2.644 . . . . 0.0 118.139 -177.248 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B 1730 ' ' VAL . . . . . . . . . . . . . 1.3 m -139.94 139.51 21.77 Favored Pre-proline 0 CA--C 1.546 0.822 0 C-N-CA 126.32 1.848 . . . . 0.0 114.436 173.884 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 68.5 Cg_endo -73.36 168.76 23.93 Favored 'Trans proline' 0 CA--C 1.543 0.974 0 C-N-CA 123.837 3.025 . . . . 0.0 113.633 -179.744 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 16.0 t -128.74 126.14 64.51 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.126 0 C-N-CA 125.194 1.398 . . . . 0.0 112.495 -177.081 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -65.79 129.12 94.25 Favored Pre-proline 0 CA--C 1.55 0.969 0 O-C-N 121.533 -0.729 . . . . 0.0 111.475 -178.542 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 26.6 Cg_endo -69.42 157.16 62.07 Favored 'Trans proline' 0 CA--C 1.544 0.985 0 C-N-CA 122.165 1.91 . . . . 0.0 112.718 -173.847 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -63.95 122.27 10.24 Favored 'Trans proline' 0 CA--C 1.538 0.682 0 C-N-CA 123.054 2.503 . . . . 0.0 111.944 -174.809 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B 1736 ' ' ARG . . . . . 0.416 ' HD3' ' CZ2' ' A' ' 562' ' ' TRP . 36.0 mtm180 -87.28 150.86 23.59 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 125.471 1.508 . . . . 0.0 110.724 179.952 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B 1737 ' ' ARG . . . . . . . . . . . . . 10.9 mmt85 -98.7 -72.53 0.65 Allowed 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 124.495 1.118 . . . . 0.0 112.801 -169.07 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B 1738 ' ' ARG . . . . . . . . . . . . . 15.5 ptt-85 -152.48 -25.75 0.17 Allowed 'General case' 0 N--CA 1.486 1.344 0 N-CA-C 116.062 1.875 . . . . 0.0 116.062 179.783 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B 1739 ' ' ARG . . . . . . . . . . . . . 2.9 ttp85 47.42 65.78 1.18 Allowed 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 127.316 2.246 . . . . 0.0 114.393 175.188 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B 1740 ' ' GLY . . . . . . . . . . . . . . . 75.15 15.45 81.11 Favored Glycine 0 CA--C 1.54 1.649 0 N-CA-C 116.691 1.436 . . . . 0.0 116.691 174.854 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B 1741 ' ' ARG . . . . . . . . . . . . . 8.8 tpm_? -131.56 94.78 3.6 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 125.334 1.453 . . . . 0.0 111.439 175.775 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B 1742 ' ' ASN . . . . . . . . . . . . . 10.3 p30 -68.61 158.78 33.31 Favored 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 123.56 0.744 . . . . 0.0 112.043 176.066 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B 1743 ' ' LEU . . . . . . . . . . . . . 55.8 tp -64.09 131.58 47.95 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.536 1.134 . . . . 0.0 113.989 -171.516 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B 1744 ' ' THR . . . . . . . . . . . . . 4.4 p . . . . . 0 C--O 1.252 1.211 0 C-N-CA 126.944 2.097 . . . . 0.0 115.823 -179.421 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 513' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.904 0 N-CA-C 110.838 -0.905 . . . . 0.0 110.838 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 514' ' ' ARG . . . . . . . . . . . . . 13.9 ptm180 -69.64 -31.14 69.06 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 114.802 1.408 . . . . 0.0 114.802 -169.999 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 54.6 mt 57.35 -26.62 0.02 OUTLIER 'General case' 0 CA--C 1.553 1.063 0 C-N-CA 128.345 2.658 . . . . 0.0 117.58 -172.589 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 516' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -73.18 161.98 29.94 Favored 'General case' 0 CA--C 1.545 0.773 0 CA-C-N 120.017 1.28 . . . . 0.0 111.336 179.172 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 14.0 mt -128.69 160.39 63.15 Favored Pre-proline 0 CA--C 1.543 0.687 0 C-N-CA 125.015 1.326 . . . . 0.0 113.419 -162.413 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_endo -66.2 159.53 49.29 Favored 'Trans proline' 0 CA--C 1.538 0.708 0 C-N-CA 123.923 3.082 . . . . 0.0 114.241 -174.039 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 96.1 Cg_endo -68.36 130.15 20.56 Favored 'Trans proline' 0 N--CA 1.457 -0.622 0 C-N-CA 123.366 2.71 . . . . 0.0 109.628 -179.742 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 78.84 1.23 83.9 Favored Glycine 0 CA--C 1.537 1.454 0 CA-C-O 116.777 -2.124 . . . . 0.0 115.578 -175.441 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 22.2 t80 -36.42 133.13 0.54 Allowed 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 117.63 2.456 . . . . 0.0 117.63 -179.751 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 31.0 mtm -100.58 -57.78 2.04 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 123.065 0.546 . . . . 0.0 111.949 -177.005 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 523' ' ' PHE . . . . . . . . . . . . . 20.3 p90 -166.68 175.09 8.15 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 126.911 2.084 . . . . 0.0 112.46 -173.233 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 66.6 mttt -107.35 162.69 13.68 Favored 'General case' 0 N--CA 1.476 0.867 0 O-C-N 120.169 -1.582 . . . . 0.0 112.178 168.629 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 5.1 m -133.33 162.5 39.68 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 C-N-CA 126.905 2.082 . . . . 0.0 109.768 164.057 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 42.5 tt0 -128.71 130.45 47.15 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-N 118.868 0.758 . . . . 0.0 111.924 169.305 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 527' ' ' ALA . . . . . . . . . . . . . . . -60.92 127.36 31.18 Favored 'General case' 0 N--CA 1.466 0.353 0 O-C-N 121.124 -0.985 . . . . 0.0 111.548 -179.677 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 61.6 mm-40 -89.94 -25.45 20.92 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 125.308 1.443 . . . . 0.0 111.973 171.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 96.5 m-70 -142.44 163.77 31.94 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 126.974 2.109 . . . . 0.0 110.257 -172.944 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 35.8 m-20 -80.03 137.4 36.8 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 123.845 0.858 . . . . 0.0 111.726 177.474 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 89.2 t80 -134.36 121.3 20.99 Favored 'General case' 0 C--O 1.236 0.358 0 N-CA-C 114.065 1.135 . . . . 0.0 114.065 175.18 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -88.22 117.11 26.9 Favored 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 115.289 1.589 . . . . 0.0 115.289 173.701 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -67.77 123.68 21.2 Favored 'General case' 0 CA--C 1.537 0.468 0 O-C-N 121.898 -0.501 . . . . 0.0 110.902 171.336 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 6.2 t -115.9 -2.04 12.43 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 126.575 1.95 . . . . 0.0 114.242 -177.281 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 39.5 m-20 -113.73 156.56 23.58 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 125.713 1.605 . . . . 0.0 115.108 157.135 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 6.7 t -59.26 -29.09 67.31 Favored 'General case' 0 CA--C 1.545 0.785 0 N-CA-C 114.33 1.234 . . . . 0.0 114.33 170.584 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -70.42 -20.17 62.94 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 116.862 2.171 . . . . 0.0 116.862 169.467 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 82.1 mt-10 -85.05 149.93 25.22 Favored 'General case' 0 CA--C 1.542 0.651 0 O-C-N 120.671 -1.268 . . . . 0.0 113.95 -170.453 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -99.89 127.83 46.03 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 126.531 1.932 . . . . 0.0 110.663 179.134 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 14.1 tt0 -88.11 127.85 35.42 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 123.47 0.708 . . . . 0.0 111.473 -179.517 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 71.1 mt -119.34 140.7 49.91 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 124.58 1.152 . . . . 0.0 111.932 -177.426 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 14.4 tppt? -107.26 138.28 43.75 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 125.883 1.673 . . . . 0.0 109.063 164.649 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -49.57 114.32 1.02 Allowed 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.771 0.829 . . . . 0.0 110.872 175.173 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 107.52 -4.89 34.99 Favored Glycine 0 CA--C 1.534 1.238 0 C-N-CA 126.693 2.092 . . . . 0.0 114.677 -175.607 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 77.0 m-20 -70.0 120.46 15.75 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 119.734 1.767 . . . . 0.0 114.958 176.546 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 27.4 t -70.92 135.23 28.5 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 CA-C-N 118.539 0.609 . . . . 0.0 110.128 166.569 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 1.4 t -126.07 121.59 59.74 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.404 0 C-N-CA 125.547 1.539 . . . . 0.0 110.474 175.375 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 30.6 mt -78.93 104.81 9.81 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 107.937 -1.135 . . . . 0.0 107.937 175.627 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 549' ' ' VAL . . . . . . . . . . . . . 30.9 t -61.03 131.71 26.14 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.901 0 CA-C-O 121.942 0.877 . . . . 0.0 113.17 170.743 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 5.6 pt -126.11 157.11 70.79 Favored Pre-proline 0 CA--C 1.542 0.672 0 C-N-CA 126.582 1.953 . . . . 0.0 108.504 175.936 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -66.62 145.89 77.51 Favored 'Trans proline' 0 N--CA 1.458 -0.595 0 C-N-CA 122.905 2.403 . . . . 0.0 110.74 176.147 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 32.8 m-85 -58.64 138.96 56.63 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 115.09 1.515 . . . . 0.0 115.09 177.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 553' ' ' GLN . . . . . . . . . . . . . 19.4 pt20 -66.2 -25.82 67.1 Favored 'General case' 0 N--CA 1.467 0.383 0 N-CA-C 113.627 0.973 . . . . 0.0 113.627 -177.43 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 58.2 m-20 -142.23 142.49 24.29 Favored Pre-proline 0 CA--C 1.544 0.725 0 C-N-CA 125.583 1.553 . . . . 0.0 110.293 167.497 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 555' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_endo -67.13 -34.39 28.48 Favored 'Trans proline' 0 CA--C 1.536 0.614 0 C-N-CA 123.671 2.914 . . . . 0.0 111.185 175.471 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 19.1 pt-20 -68.81 -14.11 62.82 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.91 1.284 . . . . 0.0 113.518 174.582 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 557' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -86.43 -21.45 27.09 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 114.145 1.165 . . . . 0.0 114.145 174.221 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 35.6 tt0 -66.21 121.91 16.27 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 113.37 0.878 . . . . 0.0 113.37 -174.628 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 66.5 m-20 -95.13 146.6 24.19 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 127.945 2.498 . . . . 0.0 113.277 176.999 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -81.55 133.9 35.44 Favored 'General case' 0 N--CA 1.472 0.664 0 O-C-N 120.364 -1.46 . . . . 0.0 113.349 -173.843 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 76.9 -1.02 64.22 Favored Glycine 0 CA--C 1.538 1.522 0 C-N-CA 124.025 0.822 . . . . 0.0 114.282 -169.841 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 57.9 m95 -97.07 158.71 15.3 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 125.859 1.663 . . . . 0.0 112.056 174.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -135.03 156.47 48.98 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 126.993 2.117 . . . . 0.0 109.486 176.884 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 51.5 ttm -119.01 141.28 48.82 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 124.285 1.034 . . . . 0.0 112.004 175.646 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -171.06 -172.08 36.93 Favored Glycine 0 CA--C 1.524 0.625 0 C-N-CA 123.817 0.722 . . . . 0.0 113.267 179.773 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 12.7 p -133.47 139.94 47.89 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 C-N-CA 126.23 1.812 . . . . 0.0 109.189 173.087 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 34.9 mtmt -57.24 136.61 56.49 Favored 'General case' 0 N--CA 1.469 0.479 0 O-C-N 121.086 -1.009 . . . . 0.0 111.308 175.865 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -60.59 -39.43 88.08 Favored 'General case' 0 CA--C 1.539 0.552 0 O-C-N 122.012 -0.43 . . . . 0.0 110.714 174.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 34.2 t -71.13 -14.16 62.19 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 113.911 1.078 . . . . 0.0 113.911 176.073 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 72.5 m-20 -83.68 -45.22 13.66 Favored 'General case' 0 CA--C 1.541 0.626 0 O-C-N 120.709 -1.244 . . . . 0.0 113.848 166.465 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 61.4 t-105 -71.39 -37.76 71.55 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.952 1.301 . . . . 0.0 114.293 179.377 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 7.0 t-20 -67.17 -13.8 62.3 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 124.808 1.243 . . . . 0.0 112.027 174.858 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 5.2 mm-40 -91.48 1.58 57.03 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 125.333 1.453 . . . . 0.0 114.395 171.217 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 48.1 m-70 60.11 35.25 21.24 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 125.275 1.43 . . . . 0.0 112.935 177.84 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 26.6 mtpp -91.58 163.19 14.22 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 125.943 1.697 . . . . 0.0 111.983 -175.829 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 10.7 pm0 -56.37 99.6 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 125.37 1.468 . . . . 0.0 114.618 -170.243 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 54.8 tp -56.22 -46.04 79.66 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 124.186 0.994 . . . . 0.0 111.718 -173.631 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 -62.73 -14.44 44.51 Favored 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 115.095 1.517 . . . . 0.0 115.095 -178.847 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 33.8 mmtp -112.48 -35.88 5.42 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.752 1.221 . . . . 0.0 113.321 175.205 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 83.0 m -67.04 -24.12 65.96 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.163 0.985 . . . . 0.0 112.297 175.517 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 17.3 ptt180 -68.49 149.75 48.89 Favored 'General case' 0 N--CA 1.47 0.526 0 N-CA-C 113.348 0.869 . . . . 0.0 113.348 175.057 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -164.44 172.59 40.25 Favored Glycine 0 CA--C 1.528 0.875 0 CA-C-N 114.598 -1.183 . . . . 0.0 113.917 174.255 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 28.4 m -92.31 143.48 11.28 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 C-N-CA 124.906 1.282 . . . . 0.0 112.108 170.339 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 45.8 p90 -138.6 154.56 73.37 Favored Pre-proline 0 CA--C 1.546 0.789 0 C-N-CA 124.786 1.234 . . . . 0.0 113.949 176.282 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -65.78 113.85 2.71 Favored 'Trans proline' 0 C--N 1.35 0.618 0 C-N-CA 122.924 2.416 . . . . 0.0 110.291 169.672 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 20.1 pt-20 -60.08 -26.0 65.84 Favored 'General case' 0 N--CA 1.479 1.002 0 O-C-N 121.493 -0.754 . . . . 0.0 112.203 -175.136 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 11.2 p-10 -71.92 -18.49 62.02 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 126.969 2.108 . . . . 0.0 113.799 -179.576 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 19.7 m-85 -72.23 -12.19 61.06 Favored 'General case' 0 N--CA 1.467 0.395 0 N-CA-C 116.276 1.954 . . . . 0.0 116.276 166.496 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 589' ' ' THR . . . . . . . . . . . . . 69.5 p -128.25 168.39 15.55 Favored 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 125.536 1.534 . . . . 0.0 110.658 -174.354 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 16.3 pt-20 -122.35 137.15 54.95 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 124.124 0.97 . . . . 0.0 109.976 174.798 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 15.3 tpp85 -64.32 131.58 47.69 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 124.706 1.202 . . . . 0.0 109.94 177.619 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 592' ' ' VAL . . . . . . . . . . . . . 2.9 m -126.4 156.86 72.09 Favored Pre-proline 0 N--CA 1.482 1.13 0 C-N-CA 125.645 1.578 . . . . 0.0 110.232 -177.545 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 593' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_endo . . . . . 0 C--O 1.252 1.202 0 C-N-CA 124.511 3.474 . . . . 0.0 113.954 -176.578 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B 1728 ' ' SER . . . . . . . . . . . . . 42.2 t . . . . . 0 N--CA 1.471 0.601 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B 1729 ' ' THR . . . . . . . . . . . . 0.28 1.4 p -64.9 -24.07 67.42 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 115.601 1.704 . . . . 0.0 115.601 172.031 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B 1730 ' ' VAL . . . . . . . . . . . . . 27.1 m -141.5 154.43 66.68 Favored Pre-proline 0 N--CA 1.478 0.974 0 C-N-CA 126.357 1.863 . . . . 0.0 111.18 -179.733 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 98.9 Cg_endo -71.68 167.11 27.42 Favored 'Trans proline' 0 CA--C 1.541 0.826 0 C-N-CA 122.809 2.339 . . . . 0.0 113.19 170.61 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 6.5 t -128.45 140.37 49.4 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.875 0 C-N-CA 126.153 1.781 . . . . 0.0 111.968 172.141 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -67.16 139.19 95.0 Favored Pre-proline 0 CA--C 1.55 0.965 0 O-C-N 121.518 -0.739 . . . . 0.0 112.835 -178.112 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -75.82 162.99 34.27 Favored 'Trans proline' 0 CA--C 1.543 0.967 0 C-N-CA 122.866 2.377 . . . . 0.0 113.204 -178.823 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 64.5 Cg_endo -69.23 149.14 69.91 Favored 'Trans proline' 0 CA--C 1.539 0.772 0 C-N-CA 123.602 2.868 . . . . 0.0 112.408 179.661 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B 1736 ' ' ARG . . . . . . . . . . . . . 56.6 mtp180 -112.53 149.59 32.48 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 126.31 1.844 . . . . 0.0 112.41 -178.514 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B 1737 ' ' ARG . . . . . . . . . . . . . 79.4 mtt180 -82.25 143.43 31.35 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 126.398 1.879 . . . . 0.0 111.665 -176.377 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B 1738 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.14 141.89 39.95 Favored 'General case' 0 N--CA 1.479 1.01 0 CA-C-O 121.097 0.475 . . . . 0.0 110.683 165.153 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B 1739 ' ' ARG . . . . . . . . . . . . . 81.4 mtt180 -106.02 160.9 14.94 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 126.238 1.815 . . . . 0.0 112.382 -172.241 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B 1740 ' ' GLY . . . . . . . . . . . . . . . 116.23 -3.43 20.48 Favored Glycine 0 CA--C 1.535 1.3 0 C-N-CA 124.936 1.255 . . . . 0.0 116.225 167.632 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B 1741 ' ' ARG . . . . . . . . . . . . . 29.5 ptt-85 -148.72 29.82 0.83 Allowed 'General case' 0 N--CA 1.484 1.234 0 CA-C-N 119.627 1.714 . . . . 0.0 113.828 171.227 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B 1742 ' ' ASN . . . . . . . . . . . . . 18.8 p-10 -102.01 161.48 13.65 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 126.039 1.736 . . . . 0.0 114.091 -177.328 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B 1743 ' ' LEU . . . . . . . . . . . . . 27.0 mt 64.92 28.94 12.59 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 127.261 2.224 . . . . 0.0 116.21 178.682 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B 1744 ' ' THR . . . . . . . . . . . . 0.351 0.2 OUTLIER . . . . . 0 N--CA 1.484 1.236 0 N-CA-C 119.088 2.995 . . . . 0.0 119.088 168.259 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 513' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.539 0 N-CA-C 112.023 -0.431 . . . . 0.0 112.023 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 514' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -108.65 172.74 6.66 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 125.921 1.688 . . . . 0.0 114.124 -171.148 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 67.0 mt -124.53 -17.65 5.94 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 125.736 1.614 . . . . 0.0 114.72 -164.495 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 516' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -107.94 155.3 20.46 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 127.416 2.287 . . . . 0.0 114.735 178.652 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 10.8 mt -131.61 160.62 66.6 Favored Pre-proline 0 CA--C 1.542 0.642 0 C-N-CA 126.272 1.829 . . . . 0.0 111.69 -172.92 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -68.25 159.09 54.74 Favored 'Trans proline' 0 CA--C 1.54 0.795 0 C-N-CA 123.302 2.668 . . . . 0.0 114.025 -172.737 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -61.61 129.96 29.84 Favored 'Trans proline' 0 N--CA 1.458 -0.607 0 C-N-CA 123.609 2.873 . . . . 0.0 110.998 178.856 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 75.79 1.11 66.0 Favored Glycine 0 CA--C 1.536 1.405 0 CA-C-O 117.294 -1.836 . . . . 0.0 115.893 -177.203 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 30.4 t80 -37.18 128.87 0.95 Allowed 'General case' 0 C--N 1.349 0.578 0 N-CA-C 117.155 2.28 . . . . 0.0 117.155 -179.405 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 56.1 mtm -100.01 -53.87 3.04 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 123.943 0.897 . . . . 0.0 113.025 -177.876 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 523' ' ' PHE . . . . . . . . . . . . . 29.1 p90 -165.93 170.67 13.46 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 126.497 1.919 . . . . 0.0 112.974 -174.159 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 524' ' ' LYS . . . . . 0.517 ' HE2' ' CD2' ' A' ' 548' ' ' LEU . 80.0 mttt -101.86 161.98 13.26 Favored 'General case' 0 N--CA 1.467 0.394 0 O-C-N 121.131 -0.981 . . . . 0.0 112.148 168.189 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 15.3 m -132.84 162.82 39.33 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 C-N-CA 126.471 1.909 . . . . 0.0 109.691 164.987 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 55.5 tt0 -127.12 130.62 50.18 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 118.827 0.739 . . . . 0.0 111.548 170.04 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 527' ' ' ALA . . . . . . . . . . . . . . . -59.53 130.9 49.15 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 123.693 0.797 . . . . 0.0 111.359 176.246 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 31.7 mm-40 -93.9 -25.79 17.16 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.372 1.469 . . . . 0.0 110.604 168.585 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 62.7 m-70 -132.55 164.86 25.69 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 127.03 2.132 . . . . 0.0 111.903 -176.691 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -85.07 132.27 34.34 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 106.504 -1.665 . . . . 0.0 106.504 175.891 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 90.0 t80 -120.62 109.99 15.9 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 124.071 0.948 . . . . 0.0 113.134 172.093 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 1.2 m -84.93 108.16 17.43 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 115.178 1.547 . . . . 0.0 115.178 173.638 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -64.25 144.38 57.19 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 125.951 1.7 . . . . 0.0 112.707 178.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 2.2 t -125.43 11.35 8.02 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 126.864 2.066 . . . . 0.0 115.44 -177.067 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 28.4 t0 -143.69 157.54 44.33 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 125.808 1.643 . . . . 0.0 107.619 177.595 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 3.2 t -69.93 -21.33 63.29 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 114.681 1.363 . . . . 0.0 114.681 165.036 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 22.9 m-20 -73.46 -19.96 60.82 Favored 'General case' 0 CA--C 1.541 0.635 0 N-CA-C 115.105 1.52 . . . . 0.0 115.105 169.497 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 73.5 mt-10 -87.13 142.34 27.99 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 125.774 1.63 . . . . 0.0 114.553 -177.425 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -88.41 131.76 34.73 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 126.717 2.007 . . . . 0.0 110.035 174.763 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -85.28 133.9 34.14 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 123.614 0.765 . . . . 0.0 110.797 172.344 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 77.0 mt -124.86 147.92 48.53 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.586 1.154 . . . . 0.0 111.957 175.574 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 7.8 tmtt? -115.47 142.98 45.99 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 126.179 1.792 . . . . 0.0 108.147 164.899 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -48.0 123.75 6.63 Favored 'General case' 0 CA--C 1.544 0.735 0 CA-C-N 119.167 0.894 . . . . 0.0 111.068 177.083 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 95.26 0.65 63.11 Favored Glycine 0 CA--C 1.534 1.245 0 C-N-CA 125.477 1.513 . . . . 0.0 114.526 -177.45 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 81.9 m-20 -72.59 119.25 16.55 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 119.249 1.525 . . . . 0.0 113.645 176.107 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 3.4 t -71.89 137.13 24.26 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.573 0 O-C-N 122.126 -0.359 . . . . 0.0 111.321 169.585 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 1.4 t -129.1 124.5 60.78 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.544 0 C-N-CA 125.625 1.57 . . . . 0.0 111.57 177.753 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 548' ' ' LEU . . . . . 0.517 ' CD2' ' HE2' ' A' ' 524' ' ' LYS . 16.7 mt -82.48 99.8 9.69 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.883 1.273 . . . . 0.0 108.581 176.756 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 549' ' ' VAL . . . . . . . . . . . . . 5.1 t -63.41 132.79 29.35 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.198 0 N-CA-C 114.692 1.367 . . . . 0.0 114.692 175.333 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 11.3 pt -129.22 156.55 78.15 Favored Pre-proline 0 CA--C 1.548 0.901 0 C-N-CA 127.09 2.156 . . . . 0.0 110.002 177.765 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -75.39 148.91 34.42 Favored 'Trans proline' 0 CA--C 1.534 0.513 0 C-N-CA 123.918 3.078 . . . . 0.0 112.058 175.678 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 552' ' ' PHE . . . . . 0.458 ' CE1' ' HA ' ' A' ' 558' ' ' GLN . 14.9 m-85 -74.55 143.78 44.34 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 114.368 1.248 . . . . 0.0 114.368 179.163 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 553' ' ' GLN . . . . . . . . . . . . . 17.7 pm0 -62.45 -25.44 67.98 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 125.787 1.635 . . . . 0.0 115.031 175.027 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 9.8 m-20 -150.45 150.27 28.42 Favored Pre-proline 0 CA--C 1.536 0.423 0 C-N-CA 125.215 1.406 . . . . 0.0 112.298 -176.63 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 555' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -66.77 -35.63 27.03 Favored 'Trans proline' 0 CA--C 1.537 0.645 0 C-N-CA 123.091 2.527 . . . . 0.0 112.061 177.153 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -72.86 -24.99 60.94 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.254 1.205 . . . . 0.0 114.254 175.138 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 557' ' ' GLU . . . . . . . . . . . . . 67.6 mm-40 -73.36 -22.53 60.26 Favored 'General case' 0 N--CA 1.473 0.714 0 O-C-N 121.451 -0.781 . . . . 0.0 112.624 171.61 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 558' ' ' GLN . . . . . 0.458 ' HA ' ' CE1' ' A' ' 552' ' ' PHE . 29.9 tt0 -78.57 153.43 31.21 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 124.432 1.093 . . . . 0.0 112.276 173.132 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -142.31 144.41 33.23 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 125.83 1.652 . . . . 0.0 114.746 -179.702 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 39.0 tp10 -68.39 129.53 40.19 Favored 'General case' 0 CA--C 1.537 0.449 0 O-C-N 121.382 -0.824 . . . . 0.0 111.934 -176.526 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 83.31 -6.77 70.63 Favored Glycine 0 CA--C 1.537 1.428 0 C-N-CA 124.76 1.172 . . . . 0.0 114.436 -175.06 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 61.9 m95 -93.09 160.81 14.69 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 125.08 1.352 . . . . 0.0 112.688 174.63 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 14.0 mt -138.08 153.44 49.3 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 126.047 1.739 . . . . 0.0 109.332 168.712 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 54.4 ttm -109.69 143.51 39.37 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 124.184 0.993 . . . . 0.0 111.277 173.54 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -172.45 -171.84 37.68 Favored Glycine 0 CA--C 1.522 0.479 0 C-N-CA 123.699 0.666 . . . . 0.0 112.758 176.907 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 12.0 p -131.77 138.68 52.26 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.503 0 C-N-CA 125.03 1.332 . . . . 0.0 108.65 171.434 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 35.5 mtmt -59.18 136.71 58.04 Favored 'General case' 0 N--CA 1.467 0.404 0 O-C-N 121.272 -0.892 . . . . 0.0 110.759 178.119 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -59.19 -41.86 89.51 Favored 'General case' 0 C--O 1.219 -0.542 0 CA-C-O 117.906 -1.045 . . . . 0.0 110.37 175.654 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 38.0 t -62.39 -33.66 75.2 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 120.247 1.385 . . . . 0.0 112.467 176.781 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 77.8 m-20 -69.16 -43.9 73.37 Favored 'General case' 0 CA--C 1.542 0.666 0 N-CA-C 115.488 1.662 . . . . 0.0 115.488 173.402 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 65.7 t-105 -72.01 -31.62 66.39 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.606 1.562 . . . . 0.0 113.203 175.671 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 46.7 t-20 -76.32 -24.12 54.29 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 127.603 2.361 . . . . 0.0 111.893 172.085 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 81.2 mt-30 -80.8 -3.82 52.42 Favored 'General case' 0 CA--C 1.544 0.733 0 O-C-N 120.961 -1.087 . . . . 0.0 113.213 163.29 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 88.2 m-70 61.12 32.64 19.62 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 125.998 1.719 . . . . 0.0 113.755 171.769 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 74.3 mttt -70.03 160.48 31.89 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.711 1.604 . . . . 0.0 111.696 175.432 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 9.2 pm0 -56.29 111.59 1.01 Allowed 'General case' 0 CA--C 1.549 0.937 0 N-CA-C 113.383 0.882 . . . . 0.0 113.383 176.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 45.5 tp -57.54 -49.48 76.21 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 124.254 1.022 . . . . 0.0 112.872 -169.8 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 65.8 mm-40 -66.19 -16.51 64.05 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 113.828 1.047 . . . . 0.0 113.828 -174.378 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 18.3 tptm -97.34 -44.78 6.74 Favored 'General case' 0 N--CA 1.465 0.322 0 C-N-CA 125.249 1.42 . . . . 0.0 112.05 174.148 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 56.5 m -76.67 -17.09 59.33 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 114.927 1.454 . . . . 0.0 114.927 -177.153 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 7.9 ptt85 -63.33 160.12 16.61 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 123.807 0.843 . . . . 0.0 112.544 169.05 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -169.14 174.5 43.61 Favored Glycine 0 CA--C 1.526 0.775 0 CA-C-N 115.564 -0.744 . . . . 0.0 113.641 170.418 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 31.3 m -91.01 139.88 16.92 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.382 0 C-N-CA 124.706 1.203 . . . . 0.0 111.164 168.274 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 41.8 p90 -135.64 154.7 78.33 Favored Pre-proline 0 CA--C 1.539 0.55 0 C-N-CA 124.831 1.253 . . . . 0.0 112.152 174.808 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -68.38 114.44 3.46 Favored 'Trans proline' 0 CA--C 1.535 0.558 0 C-N-CA 122.103 1.869 . . . . 0.0 110.103 170.66 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 15.4 pt-20 -54.02 -30.63 48.35 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.835 0.854 . . . . 0.0 112.617 -179.22 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 7.3 p-10 -70.03 -18.08 63.28 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 127.041 2.137 . . . . 0.0 113.481 -177.432 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 19.6 m-85 -72.4 -11.08 60.53 Favored 'General case' 0 CA--C 1.536 0.409 0 N-CA-C 116.442 2.016 . . . . 0.0 116.442 163.507 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 589' ' ' THR . . . . . . . . . . . . . 34.2 p -125.29 178.42 5.6 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 126.331 1.852 . . . . 0.0 112.675 -175.902 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -131.43 140.1 49.54 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 125.458 1.503 . . . . 0.0 110.089 169.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -64.11 114.19 4.01 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 124.767 1.227 . . . . 0.0 109.855 171.68 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 592' ' ' VAL . . . . . . . . . . . . . 1.3 m -95.74 155.69 38.2 Favored Pre-proline 0 N--CA 1.478 0.952 0 C-N-CA 125.308 1.443 . . . . 0.0 108.977 176.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 593' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo . . . . . 0 C--O 1.253 1.236 0 C-N-CA 124.076 3.184 . . . . 0.0 113.103 -178.445 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B 1728 ' ' SER . . . . . . . . . . . . . 28.8 t . . . . . 0 N--CA 1.48 1.028 0 N-CA-C 112.632 0.605 . . . . 0.0 112.632 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B 1729 ' ' THR . . . . . . . . . . . . . 1.7 p -76.43 -11.14 59.84 Favored 'General case' 0 N--CA 1.48 1.051 0 N-CA-C 116.863 2.171 . . . . 0.0 116.863 -171.514 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B 1730 ' ' VAL . . . . . . . . . . . . . 4.5 m -53.49 150.31 12.87 Favored Pre-proline 0 N--CA 1.475 0.776 0 C-N-CA 125.614 1.565 . . . . 0.0 113.675 177.001 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -64.34 166.21 17.79 Favored 'Trans proline' 0 CA--C 1.54 0.799 0 C-N-CA 123.058 2.505 . . . . 0.0 112.95 176.624 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 3.5 t -134.62 131.71 54.09 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 C-N-CA 125.276 1.431 . . . . 0.0 112.443 -178.087 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -68.52 133.43 90.91 Favored Pre-proline 0 CA--C 1.548 0.897 0 O-C-N 121.443 -0.786 . . . . 0.0 111.491 -176.321 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -78.58 165.13 25.37 Favored 'Trans proline' 0 CA--C 1.548 1.186 0 C-N-CA 122.982 2.455 . . . . 0.0 113.088 -178.334 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -60.53 144.93 99.57 Favored 'Trans proline' 0 CA--C 1.539 0.735 0 C-N-CA 123.533 2.822 . . . . 0.0 114.028 179.263 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B 1736 ' ' ARG . . . . . . . . . . . . . 49.3 mtp180 -115.58 160.37 20.07 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 126.153 1.781 . . . . 0.0 111.27 174.742 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B 1737 ' ' ARG . . . . . . . . . . . . . 58.9 mtt180 -73.24 170.38 15.12 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 124.692 1.197 . . . . 0.0 112.969 176.117 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B 1738 ' ' ARG . . . . . . . . . . . . . 28.4 ptt-85 -125.69 38.51 4.15 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 127.049 2.14 . . . . 0.0 112.553 -174.007 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B 1739 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.28 169.58 2.1 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 127.083 2.153 . . . . 0.0 115.302 -170.125 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B 1740 ' ' GLY . . . . . . . . . . . . . . . 80.16 -39.86 2.3 Favored Glycine 0 CA--C 1.531 1.06 0 N-CA-C 116.827 1.491 . . . . 0.0 116.827 164.412 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B 1741 ' ' ARG . . . . . . . . . . . . . 74.6 mtm180 55.16 66.57 1.19 Allowed 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 125.623 1.569 . . . . 0.0 113.749 179.539 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B 1742 ' ' ASN . . . . . . . . . . . . . 3.8 m120 -74.45 158.28 34.13 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 124.923 1.289 . . . . 0.0 111.884 174.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B 1743 ' ' LEU . . . . . . . . . . . . . 82.9 mt -111.12 -11.84 14.22 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.332 1.453 . . . . 0.0 114.761 -178.433 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B 1744 ' ' THR . . . . . . . . . . . . . 3.4 t . . . . . 0 N--CA 1.483 1.215 0 N-CA-C 115.643 1.72 . . . . 0.0 115.643 -175.841 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 513' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.941 0 N-CA-C 111.568 -0.613 . . . . 0.0 111.568 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 514' ' ' ARG . . . . . . . . . . . . . 34.6 mmt180 -104.79 168.35 9.12 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 125.292 1.437 . . . . 0.0 112.47 172.622 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 96.4 mt -95.76 -39.18 9.99 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 124.201 1.0 . . . . 0.0 111.663 171.796 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 516' ' ' ASP . . . . . . . . . . . . . 23.6 t0 -79.63 139.16 37.53 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-O 123.157 1.456 . . . . 0.0 108.583 175.406 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 13.4 mt -123.2 158.95 56.55 Favored Pre-proline 0 C--N 1.324 -0.523 0 C-N-CA 125.987 1.715 . . . . 0.0 110.526 -175.679 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_endo -65.01 160.95 39.04 Favored 'Trans proline' 0 CA--C 1.538 0.695 0 C-N-CA 122.846 2.364 . . . . 0.0 113.484 -173.253 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -58.17 135.4 68.09 Favored 'Trans proline' 0 N--CA 1.46 -0.5 0 C-N-CA 122.893 2.396 . . . . 0.0 110.541 176.911 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 69.9 0.77 28.58 Favored Glycine 0 CA--C 1.535 1.308 0 CA-C-O 117.357 -1.802 . . . . 0.0 115.893 -178.677 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 34.7 t80 -36.29 125.28 0.79 Allowed 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 121.057 2.428 . . . . 0.0 116.814 -178.538 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 63.0 mtm -98.92 -53.31 3.31 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 123.344 0.658 . . . . 0.0 112.344 -177.15 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 523' ' ' PHE . . . . . . . . . . . . . 26.8 p90 -164.39 169.14 17.75 Favored 'General case' 0 C--O 1.223 -0.318 0 C-N-CA 126.332 1.853 . . . . 0.0 112.834 -174.093 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 524' ' ' LYS . . . . . 0.554 ' HE2' ' CD2' ' A' ' 548' ' ' LEU . 87.9 mttt -100.83 163.12 12.46 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 122.219 1.009 . . . . 0.0 111.253 166.938 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 17.3 m -135.45 161.6 38.9 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 C-N-CA 126.248 1.819 . . . . 0.0 109.016 165.92 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 58.0 tt0 -124.54 130.02 51.68 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 118.39 0.541 . . . . 0.0 111.877 169.848 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 527' ' ' ALA . . . . . . . . . . . . . . . -59.59 124.13 19.1 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.988 0.915 . . . . 0.0 111.95 177.341 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 75.6 mm-40 -87.94 -25.74 23.05 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.127 1.371 . . . . 0.0 112.298 173.769 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 59.0 m-70 -139.2 167.81 21.24 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 127.177 2.191 . . . . 0.0 109.221 178.522 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 10.6 p-10 -85.22 138.81 32.11 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 125.071 1.348 . . . . 0.0 114.512 174.609 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 89.7 t80 -133.12 107.55 8.28 Favored 'General case' 0 C--O 1.235 0.299 0 C-N-CA 125.09 1.356 . . . . 0.0 111.803 179.198 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 532' ' ' THR . . . . . . . . . . . . 0.251 0.6 OUTLIER -81.61 104.55 12.1 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 113.697 0.999 . . . . 0.0 113.697 170.884 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -59.7 133.05 55.74 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 125.337 1.455 . . . . 0.0 110.895 176.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 4.4 t -109.1 -10.48 15.0 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.618 1.567 . . . . 0.0 115.047 -171.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 12.3 m-20 -133.45 153.36 51.68 Favored 'General case' 0 N--CA 1.463 0.209 0 C-N-CA 126.38 1.872 . . . . 0.0 115.745 176.929 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 536' ' ' THR . . . . . . . . . . . . 0.252 1.3 t -62.43 -27.42 69.1 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 116.582 2.067 . . . . 0.0 116.582 -171.301 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 87.2 m-20 -72.54 -17.49 61.72 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 116.407 2.002 . . . . 0.0 116.407 171.13 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 82.6 mt-10 -82.27 149.78 27.63 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.383 1.473 . . . . 0.0 114.243 -177.343 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -97.89 128.71 44.66 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 126.638 1.975 . . . . 0.0 110.422 177.651 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 15.3 tt0 -86.15 127.81 34.78 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 123.613 0.765 . . . . 0.0 111.549 178.495 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 76.9 mt -122.43 143.97 49.34 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 124.7 1.2 . . . . 0.0 112.295 -178.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 6.6 tmtm? -115.78 147.42 40.99 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 126.23 1.812 . . . . 0.0 109.329 169.717 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -54.12 120.49 6.52 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-O 121.993 0.901 . . . . 0.0 110.888 -179.613 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 100.47 0.79 55.56 Favored Glycine 0 CA--C 1.529 0.917 0 C-N-CA 125.381 1.467 . . . . 0.0 114.756 -178.481 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 80.8 m-20 -70.86 122.59 20.21 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 119.303 1.552 . . . . 0.0 113.77 -179.516 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 58.7 t -69.9 133.99 30.9 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.614 0 N-CA-C 109.198 -0.668 . . . . 0.0 109.198 166.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -126.69 124.16 64.47 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.503 0 C-N-CA 124.794 1.238 . . . . 0.0 111.41 171.757 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 548' ' ' LEU . . . . . 0.554 ' CD2' ' HE2' ' A' ' 524' ' ' LYS . 20.0 mt -80.13 100.07 8.06 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.547 1.139 . . . . 0.0 108.477 175.621 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 549' ' ' VAL . . . . . . . . . . . . . 4.1 t -63.51 132.0 29.23 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.224 0 N-CA-C 114.688 1.366 . . . . 0.0 114.688 173.837 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 17.0 pt -128.12 155.65 77.68 Favored Pre-proline 0 CA--C 1.544 0.739 0 C-N-CA 126.54 1.936 . . . . 0.0 110.435 179.186 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -70.52 152.77 65.6 Favored 'Trans proline' 0 N--CA 1.459 -0.53 0 C-N-CA 123.548 2.832 . . . . 0.0 110.619 171.329 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 52.2 m-85 -69.86 140.47 53.22 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 115.792 1.775 . . . . 0.0 115.792 -176.706 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 553' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -66.32 -14.4 61.98 Favored 'General case' 0 CA--C 1.542 0.673 0 N-CA-C 115.352 1.612 . . . . 0.0 115.352 173.846 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 4.0 m-20 -161.09 154.48 18.19 Favored Pre-proline 0 CA--C 1.543 0.701 0 C-N-CA 126.007 1.723 . . . . 0.0 111.105 171.061 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 555' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_endo -67.99 -34.59 22.72 Favored 'Trans proline' 0 CA--C 1.542 0.881 0 C-N-CA 123.398 2.732 . . . . 0.0 112.058 175.002 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -66.72 -24.13 66.2 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 113.665 0.987 . . . . 0.0 113.665 172.541 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 557' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -73.62 -19.12 60.95 Favored 'General case' 0 CA--C 1.542 0.644 0 O-C-N 120.546 -1.346 . . . . 0.0 113.469 175.312 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 40.1 tt0 -83.73 143.21 30.17 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 125.362 1.465 . . . . 0.0 113.669 -179.527 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 25.7 m-20 -127.43 149.65 49.99 Favored 'General case' 0 CA--C 1.553 1.079 0 C-N-CA 125.411 1.485 . . . . 0.0 110.8 -178.141 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -70.77 120.25 16.09 Favored 'General case' 0 N--CA 1.477 0.905 0 O-C-N 120.637 -1.289 . . . . 0.0 112.813 -170.331 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 83.68 -0.11 89.67 Favored Glycine 0 CA--C 1.54 1.636 0 C-N-CA 124.422 1.01 . . . . 0.0 115.275 -173.754 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 53.8 m95 -90.34 164.71 14.23 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 125.285 1.434 . . . . 0.0 113.437 176.102 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 11.4 mt -134.06 161.23 35.43 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 125.256 1.422 . . . . 0.0 110.517 165.657 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 55.8 ttm -116.01 145.91 42.58 Favored 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 124.853 1.261 . . . . 0.0 112.018 171.59 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -172.56 -169.44 35.2 Favored Glycine 0 CA--C 1.525 0.673 0 C-N-CA 124.402 1.001 . . . . 0.0 112.434 178.073 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 14.7 p -136.6 141.57 40.62 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 C-N-CA 125.731 1.612 . . . . 0.0 109.461 173.636 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 37.1 mtmt -58.07 135.22 56.96 Favored 'General case' 0 N--CA 1.469 0.518 0 O-C-N 121.138 -0.976 . . . . 0.0 110.788 174.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 19.5 tt0 -60.76 -39.0 87.16 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 119.636 -0.826 . . . . 0.0 110.186 174.273 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 47.3 t -58.09 -37.36 74.36 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 124.293 1.037 . . . . 0.0 112.427 177.15 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 -74.19 -44.28 54.01 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 114.959 1.466 . . . . 0.0 114.959 175.861 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 60.3 t-105 -67.67 -32.29 72.86 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.589 1.156 . . . . 0.0 112.975 176.562 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 26.7 t-20 -66.48 -35.66 80.83 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 126.414 1.886 . . . . 0.0 112.278 174.221 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 75.5 mt-30 -75.9 -5.7 47.36 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 125.566 1.546 . . . . 0.0 113.649 175.241 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 95.8 m-70 56.43 48.16 17.44 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 125.136 1.374 . . . . 0.0 112.66 -178.123 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 26.9 mttp -75.76 162.25 28.35 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 124.961 1.305 . . . . 0.0 111.778 166.533 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 14.1 pm0 -63.88 103.14 0.54 Allowed 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.379 1.072 . . . . 0.0 112.747 177.761 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 32.4 tp -58.31 -35.56 72.05 Favored 'General case' 0 CA--C 1.537 0.449 0 O-C-N 121.212 -0.93 . . . . 0.0 111.903 -174.515 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -65.08 -16.06 63.05 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 124.59 1.156 . . . . 0.0 113.885 -179.17 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 32.1 mmtp -114.28 -39.98 3.76 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 125.585 1.554 . . . . 0.0 112.442 177.623 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 39.1 m -70.51 -24.83 62.9 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 114.221 1.193 . . . . 0.0 114.221 177.063 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 17.3 ptp180 -62.01 160.97 11.46 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-N 118.91 0.777 . . . . 0.0 111.777 169.104 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -173.49 172.44 45.2 Favored Glycine 0 CA--C 1.521 0.468 0 CA-C-N 115.401 -0.818 . . . . 0.0 114.078 175.823 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 31.9 m -89.35 139.19 17.83 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.387 0 C-N-CA 124.282 1.033 . . . . 0.0 111.374 169.738 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 40.7 p90 -133.6 154.8 80.88 Favored Pre-proline 0 CA--C 1.541 0.628 0 C-N-CA 124.62 1.168 . . . . 0.0 112.889 173.381 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -65.61 110.75 1.7 Allowed 'Trans proline' 0 C--N 1.346 0.436 0 C-N-CA 122.039 1.826 . . . . 0.0 109.275 168.658 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 17.5 pt-20 -57.51 -26.93 62.07 Favored 'General case' 0 N--CA 1.474 0.744 0 O-C-N 121.506 -0.746 . . . . 0.0 112.32 -176.799 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 13.3 p-10 -71.51 -12.45 61.38 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 127.063 2.145 . . . . 0.0 114.64 178.278 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 18.4 m-85 -74.31 -13.74 60.8 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 116.862 2.171 . . . . 0.0 116.862 163.731 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 589' ' ' THR . . . . . . . . . . . . . 58.7 p -122.63 173.21 7.86 Favored 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 125.671 1.588 . . . . 0.0 111.893 -174.222 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -127.72 136.41 51.5 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 123.916 0.887 . . . . 0.0 109.691 171.731 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -64.33 120.09 11.55 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 125.567 1.547 . . . . 0.0 109.221 178.579 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 592' ' ' VAL . . . . . . . . . . . . . 2.3 m -102.39 148.16 35.04 Favored Pre-proline 0 N--CA 1.476 0.86 0 C-N-CA 124.944 1.298 . . . . 0.0 108.329 177.539 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 593' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo . . . . . 0 C--O 1.254 1.287 0 C-N-CA 124.493 3.462 . . . . 0.0 114.649 -165.014 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B 1728 ' ' SER . . . . . . . . . . . . . 10.8 t . . . . . 0 N--CA 1.477 0.898 0 N-CA-C 109.6 -0.518 . . . . 0.0 109.6 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B 1729 ' ' THR . . . . . . . . . . . . 0.463 0.6 OUTLIER 65.52 11.79 7.69 Favored 'General case' 0 N--CA 1.481 1.109 0 N-CA-C 117.874 2.546 . . . . 0.0 117.874 178.537 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B 1730 ' ' VAL . . . . . . . . . . . . . 19.2 m -136.66 151.74 73.23 Favored Pre-proline 0 N--CA 1.479 0.979 0 C-N-CA 125.754 1.622 . . . . 0.0 113.172 -177.321 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 88.9 Cg_endo -73.62 163.81 36.47 Favored 'Trans proline' 0 CA--C 1.539 0.771 0 C-N-CA 124.294 3.329 . . . . 0.0 112.612 169.908 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 4.0 p -140.26 147.35 23.49 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 C-N-CA 125.958 1.703 . . . . 0.0 109.301 170.948 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -72.34 141.55 83.42 Favored Pre-proline 0 CA--C 1.554 1.101 0 N-CA-C 113.401 0.889 . . . . 0.0 113.401 -173.641 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -79.12 168.54 20.34 Favored 'Trans proline' 0 CA--C 1.552 1.396 0 C-N-CA 123.451 2.767 . . . . 0.0 113.378 178.061 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 35.9 Cg_exo -63.98 157.72 51.38 Favored 'Trans proline' 0 CA--C 1.539 0.729 0 C-N-CA 124.217 3.278 . . . . 0.0 114.19 -179.694 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B 1736 ' ' ARG . . . . . . . . . . . . . 28.8 mtm180 -135.17 158.11 45.21 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 125.33 1.452 . . . . 0.0 112.176 -160.769 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B 1737 ' ' ARG . . . . . . . . . . . . . 36.5 mmt180 -145.13 87.17 1.8 Allowed 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 125.886 1.674 . . . . 0.0 112.569 -172.633 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B 1738 ' ' ARG . . . . . . . . . . . . . 7.7 mmp_? -62.51 146.48 51.59 Favored 'General case' 0 N--CA 1.481 1.115 0 O-C-N 121.035 -1.041 . . . . 0.0 111.817 175.031 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B 1739 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.89 171.65 4.24 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 125.323 1.449 . . . . 0.0 113.936 -167.423 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B 1740 ' ' GLY . . . . . . . . . . . . . . . 100.09 159.76 28.37 Favored Glycine 0 CA--C 1.537 1.43 0 C-N-CA 124.942 1.258 . . . . 0.0 113.43 -170.343 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B 1741 ' ' ARG . . . . . . . . . . . . . 12.7 mmp_? -75.07 -13.15 60.46 Favored 'General case' 0 N--CA 1.482 1.136 0 N-CA-C 115.898 1.814 . . . . 0.0 115.898 -165.422 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B 1742 ' ' ASN . . . . . . . . . . . . . 93.2 m-20 -100.5 126.03 46.88 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 124.363 1.065 . . . . 0.0 111.935 168.51 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B 1743 ' ' LEU . . . . . . . . . . . . . 10.8 mp -105.09 126.87 52.55 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 125.537 1.535 . . . . 0.0 109.876 170.822 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B 1744 ' ' THR . . . . . . . . . . . . . 6.8 p . . . . . 0 C--O 1.251 1.16 0 C-N-CA 126.581 1.952 . . . . 0.0 114.098 175.978 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 513' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.91 0 N-CA-C 111.137 -0.785 . . . . 0.0 111.137 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 514' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -77.7 172.94 12.64 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 125.397 1.479 . . . . 0.0 113.618 174.229 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 71.9 mt -85.76 -39.43 17.16 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.51 1.524 . . . . 0.0 112.5 172.915 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 516' ' ' ASP . . . . . . . . . . . . . 42.4 t0 -159.09 171.47 19.91 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 126.529 1.931 . . . . 0.0 108.306 -173.845 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 10.3 mt -83.56 162.55 52.94 Favored Pre-proline 0 CA--C 1.55 0.973 0 C-N-CA 124.999 1.32 . . . . 0.0 111.249 164.304 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -66.43 161.51 40.66 Favored 'Trans proline' 0 CA--C 1.538 0.709 0 C-N-CA 123.477 2.785 . . . . 0.0 114.287 -173.759 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -61.19 128.53 25.41 Favored 'Trans proline' 0 N--CA 1.459 -0.519 0 C-N-CA 123.244 2.63 . . . . 0.0 111.098 -179.4 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 73.03 6.84 69.22 Favored Glycine 0 CA--C 1.534 1.257 0 CA-C-O 117.453 -1.748 . . . . 0.0 116.238 -178.116 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 35.1 t80 -37.88 135.68 0.63 Allowed 'General case' 0 CA--C 1.547 0.865 0 CA-C-N 120.852 2.326 . . . . 0.0 117.134 -179.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 60.8 mtm -109.26 -51.5 2.87 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.448 0.699 . . . . 0.0 112.832 -179.099 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 523' ' ' PHE . . . . . . . . . . . . . 23.7 p90 -165.54 167.41 17.45 Favored 'General case' 0 C--O 1.223 -0.314 0 C-N-CA 125.984 1.713 . . . . 0.0 114.018 -174.018 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 524' ' ' LYS . . . . . 0.418 ' HE2' ' CD2' ' A' ' 548' ' ' LEU . 69.6 mttt -99.7 164.05 12.22 Favored 'General case' 0 N--CA 1.47 0.535 0 O-C-N 121.389 -0.819 . . . . 0.0 111.664 166.312 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 17.8 m -139.45 156.12 26.38 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.975 0 C-N-CA 126.952 2.101 . . . . 0.0 109.007 167.685 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 63.8 tt0 -119.01 128.88 54.79 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 119.157 0.889 . . . . 0.0 112.007 170.912 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 527' ' ' ALA . . . . . . . . . . . . . . . -60.26 117.82 5.65 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.708 1.203 . . . . 0.0 111.726 176.434 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 65.4 mm-40 -81.44 -26.36 35.4 Favored 'General case' 0 CA--C 1.537 0.442 0 C-N-CA 124.741 1.217 . . . . 0.0 111.076 170.58 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 81.3 m-70 -138.11 164.27 29.55 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 125.36 1.464 . . . . 0.0 112.476 -175.441 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . 0.253 1.7 p30 -77.41 132.33 38.45 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 115.015 1.487 . . . . 0.0 115.015 176.305 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 79.2 t80 -137.82 122.1 18.17 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 113.728 1.011 . . . . 0.0 113.728 176.707 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -87.44 125.14 34.11 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 114.665 1.357 . . . . 0.0 114.665 175.071 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -66.56 129.7 40.71 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-O 121.122 0.486 . . . . 0.0 110.851 169.561 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 4.6 p -97.9 -36.02 10.3 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 126.496 1.918 . . . . 0.0 113.777 171.436 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 96.4 m-20 -95.09 156.44 16.32 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 125.262 1.425 . . . . 0.0 114.642 176.197 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 7.7 t -54.99 -29.48 57.25 Favored 'General case' 0 N--CA 1.472 0.625 0 N-CA-C 114.665 1.357 . . . . 0.0 114.665 164.822 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 90.8 m-20 -104.97 6.13 33.26 Favored 'General case' 0 CA--C 1.544 0.726 0 N-CA-C 115.353 1.612 . . . . 0.0 115.353 175.867 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 57.3 mt-10 -86.19 152.11 23.09 Favored 'General case' 0 CA--C 1.541 0.621 0 O-C-N 120.392 -1.443 . . . . 0.0 111.103 165.0 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -101.87 132.92 47.37 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.92 1.288 . . . . 0.0 111.201 -176.294 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 29.1 tt0 -82.91 127.93 33.97 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 123.999 0.919 . . . . 0.0 109.941 174.354 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 85.0 mt -130.34 139.98 50.65 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 125.234 1.413 . . . . 0.0 111.696 -179.248 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 3.7 tmtt? -110.07 145.93 36.24 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 125.716 1.607 . . . . 0.0 110.048 168.085 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -54.54 96.06 0.01 OUTLIER 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 124.527 1.131 . . . . 0.0 112.085 173.113 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 134.01 -10.71 4.8 Favored Glycine 0 CA--C 1.536 1.377 0 C-N-CA 126.948 2.213 . . . . 0.0 114.717 -175.72 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 79.8 m-20 -77.88 127.35 32.25 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 114.962 1.467 . . . . 0.0 114.962 -170.272 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 1.9 t -77.27 135.94 25.45 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.827 0 N-CA-C 113.235 0.828 . . . . 0.0 113.235 167.899 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 1.4 t -124.59 121.91 62.55 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.358 0 C-N-CA 125.97 1.708 . . . . 0.0 110.996 175.843 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 548' ' ' LEU . . . . . 0.418 ' CD2' ' HE2' ' A' ' 524' ' ' LYS . 18.4 mt -77.22 101.98 6.45 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 108.212 -1.033 . . . . 0.0 108.212 172.202 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 549' ' ' VAL . . . . . . . . . . . . . 7.5 t -64.25 133.58 29.71 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.23 0 N-CA-C 114.548 1.314 . . . . 0.0 114.548 173.694 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 14.9 pt -130.2 159.27 71.2 Favored Pre-proline 0 CA--C 1.544 0.735 0 C-N-CA 126.728 2.011 . . . . 0.0 109.595 -178.348 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -71.1 141.72 40.47 Favored 'Trans proline' 0 C--O 1.24 0.62 0 C-N-CA 123.16 2.573 . . . . 0.0 111.83 175.848 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 45.4 m-85 -56.71 143.2 37.35 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 115.179 1.548 . . . . 0.0 115.179 166.455 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 553' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -59.45 -24.52 63.62 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 113.873 1.064 . . . . 0.0 113.873 175.188 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -161.83 152.28 14.54 Favored Pre-proline 0 CA--C 1.546 0.826 0 C-N-CA 124.855 1.262 . . . . 0.0 112.825 176.465 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 555' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -72.7 -25.17 17.54 Favored 'Trans proline' 0 CA--C 1.539 0.741 0 C-N-CA 124.195 3.263 . . . . 0.0 113.777 -177.644 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 21.7 pt-20 -70.16 -30.74 67.96 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.83 0.852 . . . . 0.0 112.36 169.34 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 557' ' ' GLU . . . . . . . . . . . . . 71.4 mm-40 -76.42 -29.21 56.95 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 124.725 1.21 . . . . 0.0 112.772 179.154 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 40.7 tt0 -66.24 120.92 14.09 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 124.604 1.162 . . . . 0.0 112.503 177.756 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 53.6 m-20 -85.31 142.3 29.44 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.884 1.274 . . . . 0.0 112.529 171.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 52.6 tp10 -78.36 131.81 37.14 Favored 'General case' 0 N--CA 1.469 0.512 0 O-C-N 120.292 -1.505 . . . . 0.0 111.368 -170.36 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 80.61 -4.05 71.0 Favored Glycine 0 CA--C 1.537 1.442 0 O-C-N 121.636 -0.665 . . . . 0.0 114.37 -173.133 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 47.5 m95 -89.75 165.27 14.27 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.21 1.404 . . . . 0.0 112.654 172.721 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 14.4 mt -134.87 154.82 51.5 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 125.545 1.538 . . . . 0.0 110.004 167.663 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 35.8 tpp -110.68 142.24 42.85 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 125.188 1.395 . . . . 0.0 110.863 171.651 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -165.07 -174.62 34.96 Favored Glycine 0 CA--C 1.526 0.744 0 O-C-N 121.336 -0.852 . . . . 0.0 113.561 174.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 13.0 p -130.62 139.71 50.58 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 C-N-CA 125.026 1.33 . . . . 0.0 108.8 169.341 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 36.3 mtmt -57.07 137.05 56.29 Favored 'General case' 0 N--CA 1.467 0.375 0 O-C-N 121.4 -0.813 . . . . 0.0 111.36 176.205 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 47.5 tt0 -60.96 -38.9 87.52 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-O 118.411 -0.804 . . . . 0.0 111.126 178.44 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 61.8 m -68.96 -31.91 71.12 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 119.504 1.047 . . . . 0.0 113.495 175.934 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 -65.57 -42.71 91.49 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 122.473 1.13 . . . . 0.0 113.924 170.057 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 46.9 t-105 -78.05 -27.58 48.75 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.668 1.187 . . . . 0.0 113.832 178.803 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 5.3 t-20 -67.04 -34.05 76.86 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 119.724 1.147 . . . . 0.0 110.98 173.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 39.3 mt-30 -73.83 -11.0 60.24 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 113.909 1.077 . . . . 0.0 113.909 165.492 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 68.7 m-70 56.68 38.44 29.54 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.434 1.494 . . . . 0.0 113.339 -178.252 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 62.5 mttt -60.82 162.82 6.31 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 125.221 1.409 . . . . 0.0 112.52 172.051 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -48.49 95.41 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 126.947 2.099 . . . . 0.0 113.867 174.786 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 49.9 tp -52.85 -47.8 67.52 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 125.801 1.64 . . . . 0.0 111.933 -169.744 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -63.33 -20.7 65.73 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 125.333 1.453 . . . . 0.0 114.601 -175.166 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 32.7 mmtp -102.73 -43.35 5.6 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.288 1.035 . . . . 0.0 111.756 176.218 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 62.1 m -63.22 -30.94 71.99 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 113.907 1.077 . . . . 0.0 113.907 176.48 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 2.7 ptt85 -62.57 166.1 5.65 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-O 122.32 1.057 . . . . 0.0 113.151 175.498 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -177.94 171.0 43.48 Favored Glycine 0 CA--C 1.524 0.646 0 CA-C-N 114.22 -1.355 . . . . 0.0 113.275 170.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 31.7 m -87.44 145.27 7.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 C-N-CA 124.983 1.313 . . . . 0.0 110.394 171.098 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 44.2 p90 -141.23 155.37 68.06 Favored Pre-proline 0 C--O 1.24 0.579 0 C-N-CA 124.115 0.966 . . . . 0.0 113.285 175.652 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -66.82 108.56 1.49 Allowed 'Trans proline' 0 N--CA 1.458 -0.561 0 C-N-CA 122.245 1.963 . . . . 0.0 109.489 169.515 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 17.7 pt-20 -55.5 -27.64 49.82 Favored 'General case' 0 N--CA 1.475 0.776 0 O-C-N 121.457 -0.777 . . . . 0.0 112.588 -177.533 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 11.5 p-10 -67.13 -21.66 65.82 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 125.967 1.707 . . . . 0.0 113.872 178.177 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 13.4 m-85 -68.53 -15.35 63.51 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 116.412 2.004 . . . . 0.0 116.412 166.407 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 589' ' ' THR . . . . . . . . . . . . . 62.7 p -120.62 174.85 6.31 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 126.065 1.746 . . . . 0.0 111.18 -177.473 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -135.64 139.77 44.02 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.886 0.874 . . . . 0.0 109.802 171.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -61.13 134.2 56.8 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 126.851 2.06 . . . . 0.0 112.157 -177.573 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 592' ' ' VAL . . . . . . . . . . . . . 3.5 m -130.86 149.43 73.65 Favored Pre-proline 0 CA--C 1.546 0.806 0 C-N-CA 124.169 0.988 . . . . 0.0 109.854 177.295 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 593' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo . . . . . 0 C--O 1.254 1.276 1 C-N-CA 125.395 4.064 . . . . 0.0 113.106 -177.472 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B 1728 ' ' SER . . . . . . . . . . . . . 47.2 t . . . . . 0 N--CA 1.475 0.784 0 CA-C-O 120.851 0.358 . . . . 0.0 110.992 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B 1729 ' ' THR . . . . . . . . . . . . 0.265 0.2 OUTLIER -101.76 -11.45 19.1 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 116.558 2.058 . . . . 0.0 116.558 -171.538 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B 1730 ' ' VAL . . . . . . . . . . . . . 2.9 m -73.58 139.72 78.07 Favored Pre-proline 0 N--CA 1.472 0.662 0 C-N-CA 124.019 0.928 . . . . 0.0 112.243 165.848 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 78.9 Cg_endo -74.83 166.32 29.54 Favored 'Trans proline' 0 CA--C 1.539 0.754 0 C-N-CA 123.675 2.916 . . . . 0.0 113.616 -179.136 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 47.0 t -136.28 134.62 49.95 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.94 0 C-N-CA 126.294 1.837 . . . . 0.0 109.643 178.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -67.52 142.56 96.37 Favored Pre-proline 0 CA--C 1.551 0.991 0 N-CA-C 112.882 0.697 . . . . 0.0 112.882 -173.551 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -73.71 162.13 40.3 Favored 'Trans proline' 0 CA--C 1.539 0.731 0 C-N-CA 122.762 2.308 . . . . 0.0 111.861 176.385 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -63.67 164.14 22.19 Favored 'Trans proline' 0 CA--C 1.539 0.76 0 C-N-CA 122.812 2.341 . . . . 0.0 112.179 178.676 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B 1736 ' ' ARG . . . . . . . . . . . . . 79.2 mtp180 -123.51 151.57 42.66 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 126.06 1.744 . . . . 0.0 109.688 177.98 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B 1737 ' ' ARG . . . . . . . . . . . . . 25.0 mmm180 -73.5 176.95 5.65 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 126.08 1.752 . . . . 0.0 113.406 -160.406 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B 1738 ' ' ARG . . . . . . . . . . . . . 75.1 mtt180 -61.3 -34.93 76.03 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 124.143 0.977 . . . . 0.0 113.202 172.538 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B 1739 ' ' ARG . . . . . . . . . . . . . 33.9 ttt85 -70.85 128.49 36.18 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 123.56 0.744 . . . . 0.0 111.554 169.103 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B 1740 ' ' GLY . . . . . . . . . . . . . . . 149.79 -173.76 29.45 Favored Glycine 0 CA--C 1.534 1.246 0 C-N-CA 125.0 1.286 . . . . 0.0 112.173 -171.54 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B 1741 ' ' ARG . . . . . . . . . . . . . 20.2 ttp85 -82.87 -0.01 46.21 Favored 'General case' 0 N--CA 1.484 1.263 0 N-CA-C 114.014 1.116 . . . . 0.0 114.014 -178.251 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B 1742 ' ' ASN . . . . . . . . . . . . . 9.5 p-10 -57.59 139.44 53.54 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.056 1.342 . . . . 0.0 112.136 169.839 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B 1743 ' ' LEU . . . . . . . . . . . . . 1.7 pt? -86.33 140.2 30.27 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 123.884 0.874 . . . . 0.0 112.218 177.313 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B 1744 ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.485 1.309 0 N-CA-C 116.518 2.044 . . . . 0.0 116.518 179.964 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 513' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.379 0 N-CA-C 112.138 -0.385 . . . . 0.0 112.138 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 514' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -66.28 157.64 31.07 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 125.122 1.369 . . . . 0.0 114.258 178.592 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -79.37 -29.88 42.34 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.535 1.534 . . . . 0.0 112.619 166.798 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 516' ' ' ASP . . . . . . . . . . . . . 18.5 p30 -123.75 153.91 40.24 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 115.53 1.678 . . . . 0.0 115.53 -178.963 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 10.0 mt -121.61 160.52 46.05 Favored Pre-proline 0 CA--C 1.544 0.718 0 C-N-CA 125.79 1.636 . . . . 0.0 112.343 -174.004 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -66.91 160.39 47.2 Favored 'Trans proline' 0 CA--C 1.538 0.695 0 C-N-CA 123.755 2.97 . . . . 0.0 113.581 -173.774 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -63.99 135.67 48.84 Favored 'Trans proline' 0 N--CA 1.456 -0.732 0 C-N-CA 123.135 2.557 . . . . 0.0 109.787 178.997 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 70.6 1.57 38.29 Favored Glycine 0 CA--C 1.535 1.314 0 CA-C-O 116.693 -2.17 . . . . 0.0 116.306 -176.299 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 30.5 t80 -35.61 135.84 0.26 Allowed 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 117.573 2.434 . . . . 0.0 117.573 -178.631 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 44.9 mtm -103.99 -64.64 1.08 Allowed 'General case' 0 C--O 1.237 0.406 0 C-N-CA 123.271 0.628 . . . . 0.0 111.595 179.872 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 523' ' ' PHE . . . . . . . . . . . . . 41.6 p90 -158.78 174.55 14.85 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 124.781 1.232 . . . . 0.0 112.881 -175.39 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 524' ' ' LYS . . . . . 0.536 ' HE2' ' CD2' ' A' ' 548' ' ' LEU . 78.8 mttt -108.0 160.93 15.4 Favored 'General case' 0 N--CA 1.472 0.661 0 O-C-N 121.173 -0.954 . . . . 0.0 112.593 173.524 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 16.7 m -136.5 159.7 37.86 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 C-N-CA 126.698 1.999 . . . . 0.0 109.926 167.385 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 60.7 tt0 -122.55 130.88 53.5 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 124.031 0.932 . . . . 0.0 112.591 169.749 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 527' ' ' ALA . . . . . . . . . . . . . . . -63.44 121.42 13.78 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.753 1.221 . . . . 0.0 112.613 178.289 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 60.6 mm-40 -84.32 -22.75 30.53 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.345 1.458 . . . . 0.0 111.986 172.974 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 97.7 m-70 -142.72 161.88 36.93 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 126.418 1.887 . . . . 0.0 111.135 -168.672 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -87.8 123.39 32.54 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.981 1.712 . . . . 0.0 115.344 -179.729 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 78.2 t80 -130.56 113.45 14.25 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 124.33 1.052 . . . . 0.0 112.148 -176.241 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 1.2 m -89.33 127.07 35.76 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 124.636 1.175 . . . . 0.0 114.075 169.561 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -74.13 132.12 41.95 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-O 122.545 1.165 . . . . 0.0 112.778 -173.912 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 534' ' ' THR . . . . . . . . . . . . 0.289 3.3 t -108.97 14.88 23.82 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 126.214 1.806 . . . . 0.0 114.624 -177.928 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 24.9 t0 -150.7 159.34 44.58 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.86 1.264 . . . . 0.0 108.074 175.837 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 1.4 t -72.54 -10.43 59.78 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 115.01 1.485 . . . . 0.0 115.01 167.45 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 95.4 m-20 -76.64 -25.24 53.6 Favored 'General case' 0 N--CA 1.47 0.547 0 N-CA-C 116.379 1.992 . . . . 0.0 116.379 162.968 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 70.6 mt-10 -87.17 153.64 21.35 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 114.229 1.196 . . . . 0.0 114.229 -166.598 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -100.04 129.35 46.08 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 126.91 2.084 . . . . 0.0 110.051 176.549 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 18.4 tt0 -80.43 130.27 35.05 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.474 0.709 . . . . 0.0 110.198 173.183 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 78.2 mt -124.58 146.64 48.93 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 124.771 1.229 . . . . 0.0 111.067 176.721 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -116.77 149.21 40.3 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 124.474 1.11 . . . . 0.0 109.403 167.071 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -54.29 105.91 0.17 Allowed 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 123.233 0.613 . . . . 0.0 111.753 176.097 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 121.31 -8.64 10.32 Favored Glycine 0 CA--C 1.534 1.25 0 C-N-CA 126.678 2.085 . . . . 0.0 114.1 -177.826 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 84.6 m-20 -78.91 123.91 27.73 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 119.414 1.607 . . . . 0.0 114.757 -172.679 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 2.4 t -73.17 138.8 20.62 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 C-N-CA 123.74 0.816 . . . . 0.0 112.049 171.816 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -129.13 124.69 61.11 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.41 0 C-N-CA 125.192 1.397 . . . . 0.0 111.594 176.567 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 548' ' ' LEU . . . . . 0.536 ' CD2' ' HE2' ' A' ' 524' ' ' LYS . 17.3 mt -81.23 98.27 8.02 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.568 1.147 . . . . 0.0 108.134 176.252 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 549' ' ' VAL . . . . . . . . . . . . . 3.0 t -57.74 125.05 13.12 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.111 0 N-CA-C 113.548 0.944 . . . . 0.0 113.548 169.579 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 6.0 pt -122.76 157.53 59.51 Favored Pre-proline 0 N--CA 1.473 0.722 0 C-N-CA 126.641 1.976 . . . . 0.0 108.981 178.437 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -63.83 149.62 90.29 Favored 'Trans proline' 0 N--CA 1.461 -0.41 0 C-N-CA 122.635 2.223 . . . . 0.0 110.272 173.863 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 552' ' ' PHE . . . . . 0.437 ' CE1' ' HA ' ' A' ' 558' ' ' GLN . 29.3 m-85 -66.1 137.48 57.08 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 116.188 1.921 . . . . 0.0 116.188 179.699 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 553' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -67.09 -21.36 65.87 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 115.191 1.552 . . . . 0.0 115.191 -176.172 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 6.4 m-20 -160.09 154.59 20.4 Favored Pre-proline 0 CA--C 1.547 0.832 0 C-N-CA 125.384 1.474 . . . . 0.0 110.881 177.392 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 555' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -69.95 -29.66 22.63 Favored 'Trans proline' 0 CA--C 1.538 0.699 0 C-N-CA 123.938 3.092 . . . . 0.0 112.891 178.127 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 3.1 pt-20 -72.04 -16.32 62.04 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 113.395 0.887 . . . . 0.0 113.395 170.627 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 557' ' ' GLU . . . . . . . . . . . . . 53.2 mm-40 -90.0 -15.51 31.74 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 124.91 1.284 . . . . 0.0 113.965 -178.591 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 558' ' ' GLN . . . . . 0.437 ' HA ' ' CE1' ' A' ' 552' ' ' PHE . 40.6 tt0 -89.07 132.14 34.91 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 125.471 1.508 . . . . 0.0 113.782 -179.49 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -125.93 144.26 50.76 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 125.005 1.322 . . . . 0.0 108.665 -170.954 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -77.64 129.9 36.16 Favored 'General case' 0 N--CA 1.475 0.782 0 O-C-N 120.205 -1.559 . . . . 0.0 112.666 -171.35 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 81.41 -0.42 87.84 Favored Glycine 0 CA--C 1.539 1.543 0 C-N-CA 124.37 0.986 . . . . 0.0 114.703 -172.967 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 54.0 m95 -102.59 162.69 12.73 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 126.789 2.036 . . . . 0.0 112.508 175.14 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 11.1 mt -138.74 154.86 48.57 Favored 'General case' 0 N--CA 1.472 0.655 0 O-C-N 121.146 -0.971 . . . . 0.0 110.894 172.864 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 48.3 ttm -112.79 139.88 48.04 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 124.983 1.313 . . . . 0.0 111.718 -179.164 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -170.08 -174.77 38.52 Favored Glycine 0 CA--C 1.522 0.528 0 C-N-CA 124.292 0.948 . . . . 0.0 112.732 178.264 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 13.8 p -128.24 140.29 49.6 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.493 0 C-N-CA 125.48 1.512 . . . . 0.0 109.118 170.416 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 36.3 mtmt -59.89 136.17 57.92 Favored 'General case' 0 N--CA 1.465 0.317 0 O-C-N 121.459 -0.775 . . . . 0.0 111.056 176.694 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -57.94 -40.55 80.78 Favored 'General case' 0 C--O 1.22 -0.453 0 CA-C-O 118.096 -0.954 . . . . 0.0 110.558 176.927 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 52.3 m -59.32 -44.05 92.63 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 119.903 1.228 . . . . 0.0 113.017 175.11 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -62.64 -35.2 78.85 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 115.336 1.606 . . . . 0.0 115.336 173.465 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 69.6 t-105 -79.54 -31.86 42.13 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.63 1.172 . . . . 0.0 113.332 175.476 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 21.8 t-20 -71.69 -30.23 65.45 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 126.332 1.853 . . . . 0.0 111.845 177.913 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 50.6 mt-30 -83.11 3.49 30.45 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 114.022 1.119 . . . . 0.0 114.022 171.127 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 55.3 m-70 57.93 30.18 18.74 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 126.316 1.846 . . . . 0.0 114.148 178.963 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 45.5 mttt -68.01 161.54 26.41 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 124.838 1.255 . . . . 0.0 111.351 174.296 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 20.0 pt-20 -56.4 105.92 0.24 Allowed 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 124.654 1.181 . . . . 0.0 114.122 -177.64 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 42.5 tp -54.39 -48.86 71.06 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 125.094 1.357 . . . . 0.0 112.14 -173.827 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 21.1 pm0 -59.05 -18.83 38.39 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 126.301 1.84 . . . . 0.0 114.974 -177.508 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 66.7 mmtt -124.74 -8.68 7.31 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 115.606 1.706 . . . . 0.0 115.606 177.403 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 97.9 m -80.16 -32.34 38.82 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 123.984 0.914 . . . . 0.0 112.27 163.422 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 36.4 ptt180 -61.61 157.12 18.17 Favored 'General case' 0 N--CA 1.474 0.733 0 O-C-N 121.378 -0.826 . . . . 0.0 112.724 174.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -170.2 174.86 44.3 Favored Glycine 0 CA--C 1.524 0.634 0 C-N-CA 124.643 1.116 . . . . 0.0 113.139 174.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 21.5 m -93.77 142.67 12.96 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 C-N-CA 124.553 1.141 . . . . 0.0 111.682 169.427 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 38.9 p90 -136.18 154.48 77.36 Favored Pre-proline 0 CA--C 1.539 0.525 0 C-N-CA 125.057 1.343 . . . . 0.0 112.863 176.699 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -66.21 112.85 2.43 Favored 'Trans proline' 0 N--CA 1.457 -0.65 0 C-N-CA 121.62 1.547 . . . . 0.0 108.845 169.57 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 22.1 pt-20 -52.73 -33.35 47.62 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 123.265 0.626 . . . . 0.0 111.821 -179.37 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 9.8 p-10 -69.99 -10.84 60.01 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 127.473 2.309 . . . . 0.0 114.636 -178.637 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 16.5 m-85 -77.24 -11.68 59.86 Favored 'General case' 0 N--CA 1.468 0.466 0 N-CA-C 116.82 2.155 . . . . 0.0 116.82 162.199 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 589' ' ' THR . . . . . . . . . . . . . 67.8 p -129.82 170.47 13.84 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 125.992 1.717 . . . . 0.0 111.779 -174.272 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -131.36 137.49 48.76 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 124.162 0.985 . . . . 0.0 110.74 175.985 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 12.9 tpt180 -56.98 135.12 56.21 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 126.366 1.866 . . . . 0.0 112.023 177.388 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 592' ' ' VAL . . . . . . . . . . . . . 2.1 m -130.29 153.55 81.27 Favored Pre-proline 0 N--CA 1.481 1.084 0 C-N-CA 125.975 1.71 . . . . 0.0 109.304 176.13 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 593' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo . . . . . 0 C--O 1.251 1.166 0 C-N-CA 124.364 3.376 . . . . 0.0 115.479 -167.462 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B 1728 ' ' SER . . . . . . . . . . . . . 45.6 m . . . . . 0 N--CA 1.479 0.986 0 N-CA-C 112.209 0.448 . . . . 0.0 112.209 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B 1729 ' ' THR . . . . . . . . . . . . 0.439 0.6 OUTLIER 57.11 36.38 27.51 Favored 'General case' 0 N--CA 1.482 1.133 0 N-CA-C 116.375 1.991 . . . . 0.0 116.375 177.158 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B 1730 ' ' VAL . . . . . . . . . . . . . 1.5 m -77.61 145.68 71.76 Favored Pre-proline 0 N--CA 1.474 0.744 0 N-CA-C 114.72 1.378 . . . . 0.0 114.72 -173.685 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -69.68 168.25 22.0 Favored 'Trans proline' 0 CA--C 1.539 0.761 0 C-N-CA 124.003 3.135 . . . . 0.0 114.459 179.522 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 65.6 t -129.86 133.82 64.07 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.842 0 C-N-CA 126.268 1.827 . . . . 0.0 109.709 177.379 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -68.51 132.22 91.29 Favored Pre-proline 0 CA--C 1.549 0.912 0 O-C-N 121.651 -0.655 . . . . 0.0 111.887 179.764 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -75.78 167.0 27.19 Favored 'Trans proline' 0 CA--C 1.544 0.979 0 C-N-CA 122.134 1.889 . . . . 0.0 112.019 -177.503 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 73.8 Cg_exo -50.4 151.85 9.35 Favored 'Trans proline' 0 C--N 1.347 0.5 0 C-N-CA 124.012 3.141 . . . . 0.0 112.654 169.931 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B 1736 ' ' ARG . . . . . . . . . . . . . 1.2 ptm180 -162.73 129.52 3.56 Favored 'General case' 0 N--CA 1.466 0.355 0 C-N-CA 124.227 1.011 . . . . 0.0 112.221 172.274 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B 1737 ' ' ARG . . . . . . . . . . . . . 2.3 ptm180 -47.82 155.67 0.39 Allowed 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 127.192 2.197 . . . . 0.0 113.298 166.891 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B 1738 ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -132.65 151.62 51.91 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 124.959 1.303 . . . . 0.0 112.577 -176.206 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B 1739 ' ' ARG . . . . . . . . . . . . . 2.4 mpp_? -90.14 149.25 22.53 Favored 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 115.257 1.577 . . . . 0.0 115.257 -161.039 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B 1740 ' ' GLY . . . . . . . . . . . . . . . -86.65 -160.63 34.9 Favored Glycine 0 CA--C 1.535 1.304 0 C-N-CA 125.06 1.315 . . . . 0.0 112.963 167.207 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B 1741 ' ' ARG . . . . . . . . . . . . . 12.0 mmp_? -59.83 120.79 10.25 Favored 'General case' 0 N--CA 1.479 0.992 0 O-C-N 121.54 -0.976 . . . . 0.0 111.417 174.276 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B 1742 ' ' ASN . . . . . . . . . . . . . 4.8 m-20 -84.45 93.26 8.26 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.363 0.665 . . . . 0.0 110.366 171.031 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B 1743 ' ' LEU . . . . . . . . . . . . . 56.3 tp -64.95 106.94 1.35 Allowed 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 124.183 0.993 . . . . 0.0 110.442 179.858 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B 1744 ' ' THR . . . . . . . . . . . . 0.279 1.4 m . . . . . 0 C--O 1.251 1.172 0 C-N-CA 125.847 1.659 . . . . 0.0 114.029 -171.109 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 513' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 1.007 0 N-CA-C 110.917 -0.873 . . . . 0.0 110.917 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 514' ' ' ARG . . . . . . . . . . . . . 4.9 mmp_? -84.89 161.01 20.02 Favored 'General case' 0 N--CA 1.483 1.219 0 N-CA-C 114.64 1.348 . . . . 0.0 114.64 -174.787 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 64.7 tp -98.81 -42.75 7.05 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.724 1.61 . . . . 0.0 111.691 169.019 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 516' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -74.79 136.08 41.68 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 124.595 1.158 . . . . 0.0 113.997 174.515 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 10.4 mt -128.0 155.77 77.24 Favored Pre-proline 0 CA--C 1.537 0.475 0 C-N-CA 125.585 1.554 . . . . 0.0 112.445 -169.617 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -65.52 158.22 54.17 Favored 'Trans proline' 0 CA--C 1.537 0.674 0 C-N-CA 123.882 3.055 . . . . 0.0 113.756 -169.482 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -62.2 133.42 43.61 Favored 'Trans proline' 0 N--CA 1.456 -0.733 0 C-N-CA 123.306 2.671 . . . . 0.0 109.809 177.705 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 75.13 3.17 68.52 Favored Glycine 0 CA--C 1.534 1.247 0 CA-C-O 117.73 -1.594 . . . . 0.0 115.432 -175.347 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 37.2 t80 -42.6 125.55 3.34 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 121.024 2.412 . . . . 0.0 116.21 178.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 60.5 mtm -97.06 -47.76 5.66 Favored 'General case' 0 N--CA 1.471 0.575 0 C-N-CA 123.782 0.833 . . . . 0.0 112.546 -177.195 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 523' ' ' PHE . . . . . . . . . . . . . 23.8 p90 -171.15 167.19 7.15 Favored 'General case' 0 C--O 1.223 -0.321 0 C-N-CA 128.177 2.591 . . . . 0.0 112.504 -176.404 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 524' ' ' LYS . . . . . 0.521 ' HE2' ' CD2' ' A' ' 548' ' ' LEU . 85.1 mttt -96.9 160.71 14.2 Favored 'General case' 0 N--CA 1.47 0.539 0 O-C-N 120.871 -1.143 . . . . 0.0 111.653 165.365 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 16.4 m -133.09 161.36 41.69 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 C-N-CA 125.334 1.453 . . . . 0.0 109.959 163.18 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 43.8 tt0 -128.33 128.92 45.49 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 124.009 0.923 . . . . 0.0 111.875 174.841 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 527' ' ' ALA . . . . . . . . . . . . . . . -62.83 123.52 18.69 Favored 'General case' 0 CA--C 1.538 0.484 0 O-C-N 121.547 -0.721 . . . . 0.0 111.576 -178.584 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 42.3 mm-40 -87.24 -32.96 19.48 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 124.785 1.234 . . . . 0.0 110.044 168.888 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 97.6 m-70 -130.54 153.66 48.62 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 126.54 1.936 . . . . 0.0 110.798 179.039 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -79.42 141.6 36.69 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 125.276 1.43 . . . . 0.0 113.182 176.566 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 86.4 t80 -134.0 128.2 33.88 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 115.397 1.629 . . . . 0.0 115.397 -174.974 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -92.9 112.13 23.98 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 116.268 1.951 . . . . 0.0 116.268 177.983 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -67.7 130.69 43.78 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 123.835 0.854 . . . . 0.0 111.026 171.81 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 534' ' ' THR . . . . . . . . . . . . 0.259 12.1 t -136.39 31.23 2.89 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 125.946 1.698 . . . . 0.0 112.694 179.739 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 41.1 t0 -146.66 169.99 17.87 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 125.086 1.354 . . . . 0.0 109.056 167.364 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 1.1 t -67.6 -26.77 66.43 Favored 'General case' 0 N--CA 1.47 0.536 0 N-CA-C 115.871 1.804 . . . . 0.0 115.871 168.048 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 35.6 t0 -76.51 -27.71 56.13 Favored 'General case' 0 CA--C 1.547 0.852 0 O-C-N 121.069 -1.02 . . . . 0.0 110.887 178.363 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 60.3 mt-10 -80.76 149.29 29.71 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 115.404 1.631 . . . . 0.0 115.404 -164.596 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -101.62 137.88 39.35 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 128.967 2.907 . . . . 0.0 109.866 174.506 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 19.9 tt0 -95.47 134.95 37.73 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 123.994 0.917 . . . . 0.0 111.064 175.892 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 80.1 mt -125.68 148.1 49.13 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.388 1.075 . . . . 0.0 112.647 -178.189 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 3.1 tppp? -113.57 141.31 47.33 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 126.85 2.06 . . . . 0.0 109.497 164.491 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -52.47 114.02 1.24 Allowed 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 119.025 0.829 . . . . 0.0 110.982 173.575 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 115.61 -15.41 17.18 Favored Glycine 0 CA--C 1.529 0.936 0 C-N-CA 126.024 1.773 . . . . 0.0 113.463 -173.161 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 78.3 m-20 -66.83 118.63 10.61 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 118.953 1.377 . . . . 0.0 113.873 -178.037 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 45.9 t -72.53 134.75 29.22 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 166.791 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -127.49 123.08 60.82 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.386 0 C-N-CA 125.856 1.662 . . . . 0.0 111.184 175.86 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 548' ' ' LEU . . . . . 0.521 ' CD2' ' HE2' ' A' ' 524' ' ' LYS . 22.3 mt -81.39 98.84 8.39 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.894 1.278 . . . . 0.0 108.393 178.438 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 549' ' ' VAL . . . . . . . . . . . . . 3.4 t -62.43 131.97 27.98 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.236 0 N-CA-C 114.772 1.397 . . . . 0.0 114.772 175.812 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 18.2 pt -133.24 158.24 76.23 Favored Pre-proline 0 CA--C 1.551 1.011 0 C-N-CA 127.134 2.173 . . . . 0.0 109.935 177.859 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 82.8 Cg_endo -71.16 154.51 62.01 Favored 'Trans proline' 0 CA--C 1.537 0.626 0 C-N-CA 124.031 3.154 . . . . 0.0 112.016 174.639 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 24.5 m-85 -67.18 159.58 28.71 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 116.747 2.129 . . . . 0.0 116.747 -174.728 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 553' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -65.75 -24.7 67.01 Favored 'General case' 0 N--CA 1.476 0.827 0 O-C-N 121.127 -0.983 . . . . 0.0 113.222 172.584 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 53.5 m-20 -157.99 150.76 18.15 Favored Pre-proline 0 CA--C 1.544 0.712 0 C-N-CA 126.421 1.888 . . . . 0.0 111.538 177.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 555' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -66.46 -35.45 30.4 Favored 'Trans proline' 0 CA--C 1.539 0.772 0 C-N-CA 123.107 2.538 . . . . 0.0 111.406 168.39 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 23.8 pt-20 -71.08 -9.12 57.51 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.423 1.489 . . . . 0.0 114.108 172.306 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 557' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 -97.07 -25.63 15.28 Favored 'General case' 0 N--CA 1.478 0.942 0 O-C-N 121.123 -0.986 . . . . 0.0 113.561 166.961 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 42.7 tt0 -65.53 118.72 9.87 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 124.023 0.929 . . . . 0.0 113.053 -177.448 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 50.6 m-20 -90.84 128.65 36.81 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 126.012 1.725 . . . . 0.0 110.886 -179.246 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 6.0 tm-20 -65.04 135.1 55.19 Favored 'General case' 0 N--CA 1.475 0.814 0 O-C-N 120.358 -1.464 . . . . 0.0 111.608 -178.701 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 80.51 -5.72 63.42 Favored Glycine 0 CA--C 1.538 1.524 0 C-N-CA 124.25 0.928 . . . . 0.0 115.229 -174.651 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 48.0 m95 -93.95 167.15 11.79 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 125.199 1.4 . . . . 0.0 112.87 172.846 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 16.8 mt -134.36 160.15 38.83 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 124.49 1.116 . . . . 0.0 110.328 165.177 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 38.1 ttm -114.77 143.45 45.06 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 124.976 1.31 . . . . 0.0 111.307 175.503 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -170.58 -172.5 36.99 Favored Glycine 0 CA--C 1.523 0.586 0 CA-C-O 121.687 0.604 . . . . 0.0 113.304 176.288 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 14.5 p -132.54 136.91 55.29 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 C-N-CA 125.595 1.558 . . . . 0.0 109.214 173.226 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 40.4 mtmt -62.86 137.85 58.38 Favored 'General case' 0 N--CA 1.465 0.318 0 O-C-N 121.085 -1.009 . . . . 0.0 111.805 178.758 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 71.2 tt0 -58.04 -44.89 87.64 Favored 'General case' 0 C--O 1.222 -0.356 0 CA-C-O 118.268 -0.872 . . . . 0.0 110.866 -178.15 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 10.5 t -63.92 -26.5 68.62 Favored 'General case' 0 CA--C 1.546 0.79 0 CA-C-N 119.735 1.152 . . . . 0.0 112.983 -177.427 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -72.84 -48.23 39.49 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 126.69 1.996 . . . . 0.0 109.452 175.951 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 64.6 t-105 -67.64 -30.3 69.82 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.443 1.497 . . . . 0.0 113.003 176.154 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 33.8 t-20 -76.17 -25.68 55.48 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 127.009 2.124 . . . . 0.0 112.202 175.869 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 32.0 mt-30 -80.1 3.22 21.12 Favored 'General case' 0 CA--C 1.546 0.797 0 N-CA-C 113.375 0.88 . . . . 0.0 113.375 160.351 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 95.0 m-70 54.38 34.43 20.73 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 126.241 1.816 . . . . 0.0 114.491 175.697 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 5.6 mtpm? -75.05 158.17 33.61 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 125.289 1.436 . . . . 0.0 111.758 178.092 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 8.1 pm0 -53.18 108.83 0.36 Allowed 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.738 1.615 . . . . 0.0 114.37 -176.707 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 64.0 tp -57.0 -47.29 81.19 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 125.197 1.399 . . . . 0.0 112.945 -170.041 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 56.6 mt-10 -68.13 -24.07 64.97 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 114.488 1.292 . . . . 0.0 114.488 -174.852 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 43.1 mmtm -85.52 -47.05 10.27 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 123.618 0.767 . . . . 0.0 111.816 168.692 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 89.5 m -67.45 -28.53 67.96 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 114.381 1.252 . . . . 0.0 114.381 -172.13 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 36.2 ptt180 -64.63 163.27 14.07 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 124.635 1.174 . . . . 0.0 113.505 175.428 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -171.63 172.9 44.85 Favored Glycine 0 CA--C 1.531 1.057 0 C-N-CA 125.092 1.33 . . . . 0.0 114.27 174.449 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 14.7 m -91.67 143.97 10.2 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.61 0 C-N-CA 125.522 1.529 . . . . 0.0 112.639 170.847 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 49.3 p90 -142.25 155.59 64.69 Favored Pre-proline 0 CA--C 1.545 0.778 0 C-N-CA 124.876 1.27 . . . . 0.0 112.91 176.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_endo -69.08 110.3 2.38 Favored 'Trans proline' 0 C--N 1.348 0.548 0 C-N-CA 122.453 2.102 . . . . 0.0 109.973 171.651 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -57.3 -25.1 58.76 Favored 'General case' 0 N--CA 1.474 0.761 0 O-C-N 121.311 -0.868 . . . . 0.0 113.273 -179.364 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 8.7 p-10 -70.24 -9.51 56.1 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.33 1.452 . . . . 0.0 114.464 176.726 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 18.6 m-85 -80.22 -12.64 59.61 Favored 'General case' 0 CA--C 1.539 0.539 0 N-CA-C 116.668 2.099 . . . . 0.0 116.668 164.949 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 589' ' ' THR . . . . . . . . . . . . . 39.4 p -127.26 176.87 7.08 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 125.543 1.537 . . . . 0.0 110.591 -170.727 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 16.7 pt-20 -134.67 147.98 50.25 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 124.96 1.304 . . . . 0.0 110.747 173.085 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 2.7 tmm_? -60.21 136.85 58.15 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 124.631 1.173 . . . . 0.0 112.812 173.054 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 592' ' ' VAL . . . . . . . . . . . . . 1.1 m -139.76 154.84 71.33 Favored Pre-proline 0 CA--C 1.549 0.909 0 C-N-CA 126.752 2.021 . . . . 0.0 109.302 177.099 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 593' ' ' PRO . . . . . . . . . . . . . 81.6 Cg_endo . . . . . 0 C--O 1.251 1.158 1 C-N-CA 125.433 4.089 . . . . 0.0 113.788 -178.652 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B 1728 ' ' SER . . . . . . . . . . . . . 44.8 t . . . . . 0 N--CA 1.475 0.823 0 CA-C-O 120.548 0.213 . . . . 0.0 110.772 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B 1729 ' ' THR . . . . . . . . . . . . 0.43 0.7 OUTLIER 69.97 9.35 7.07 Favored 'General case' 0 N--CA 1.482 1.129 0 N-CA-C 118.139 2.644 . . . . 0.0 118.139 173.283 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B 1730 ' ' VAL . . . . . . . . . . . . . 28.8 m -65.8 149.4 97.51 Favored Pre-proline 0 N--CA 1.478 0.935 0 C-N-CA 125.168 1.387 . . . . 0.0 112.39 179.371 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -65.66 174.98 4.79 Favored 'Trans proline' 0 CA--C 1.544 0.988 0 C-N-CA 124.541 3.494 . . . . 0.0 114.065 178.921 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 7.7 p -139.82 136.27 38.98 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 C-N-CA 125.3 1.44 . . . . 0.0 111.815 179.634 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -70.24 141.76 89.09 Favored Pre-proline 0 CA--C 1.553 1.081 0 O-C-N 121.496 -0.752 . . . . 0.0 112.915 -176.276 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -74.37 163.88 35.3 Favored 'Trans proline' 0 CA--C 1.543 0.93 0 C-N-CA 122.804 2.336 . . . . 0.0 111.947 174.329 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -65.57 148.43 87.4 Favored 'Trans proline' 0 CA--C 1.541 0.862 0 C-N-CA 122.581 2.187 . . . . 0.0 112.116 179.396 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B 1736 ' ' ARG . . . . . . . . . . . . . 31.4 mtp-105 -107.15 144.92 33.18 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 124.809 1.244 . . . . 0.0 112.159 169.828 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B 1737 ' ' ARG . . . . . . . . . . . . . 9.3 mmt85 -103.64 159.69 15.39 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 124.926 1.29 . . . . 0.0 113.761 -151.66 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B 1738 ' ' ARG . . . . . . . . . . . . . 31.3 tpt85 -63.08 -39.42 94.66 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 125.19 1.396 . . . . 0.0 113.17 -175.539 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B 1739 ' ' ARG . . . . . . . . . . . . . 9.5 mtt85 -170.65 101.21 0.24 Allowed 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 128.851 2.86 . . . . 0.0 109.293 152.37 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B 1740 ' ' GLY . . . . . . . . . . . . . . . 57.19 -139.57 46.2 Favored Glycine 0 CA--C 1.535 1.297 0 C-N-CA 124.305 0.955 . . . . 0.0 114.325 175.364 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B 1741 ' ' ARG . . . . . . . . . . . . . 14.2 mmm180 -108.52 7.46 26.82 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 124.808 1.243 . . . . 0.0 113.828 177.007 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B 1742 ' ' ASN . . . . . . . . . . . . . 47.9 t30 -77.54 73.85 4.1 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 125.239 1.415 . . . . 0.0 111.498 178.397 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B 1743 ' ' LEU . . . . . . . . . . . . . 51.4 mt -72.75 -20.33 61.21 Favored 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 114.623 1.342 . . . . 0.0 114.623 -170.304 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B 1744 ' ' THR . . . . . . . . . . . . 0.325 0.6 OUTLIER . . . . . 0 C--O 1.251 1.141 0 N-CA-C 117.56 2.429 . . . . 0.0 117.56 -176.487 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 513' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 1.088 0 N-CA-C 111.843 -0.503 . . . . 0.0 111.843 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 514' ' ' ARG . . . . . . . . . . . . . 11.8 mmt180 -69.02 -43.23 75.19 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 125.218 1.407 . . . . 0.0 114.164 -174.694 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 44.0 mt 65.36 -15.75 0.1 Allowed 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 128.78 2.832 . . . . 0.0 115.401 -158.287 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 516' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -77.77 157.36 30.04 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.206 1.402 . . . . 0.0 113.908 174.331 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 18.0 mt -136.21 160.97 64.99 Favored Pre-proline 0 CA--C 1.547 0.832 0 C-N-CA 125.719 1.608 . . . . 0.0 113.731 -160.626 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 34.8 Cg_endo -67.3 161.07 44.72 Favored 'Trans proline' 0 CA--C 1.54 0.805 0 C-N-CA 124.296 3.331 . . . . 0.0 114.298 -173.72 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -63.87 128.26 21.54 Favored 'Trans proline' 0 C--N 1.35 0.616 0 C-N-CA 123.065 2.51 . . . . 0.0 110.414 -178.623 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 75.34 3.9 72.26 Favored Glycine 0 CA--C 1.534 1.221 0 CA-C-O 117.425 -1.764 . . . . 0.0 115.367 -177.246 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 31.7 t80 -36.17 132.19 0.56 Allowed 'General case' 0 CA--C 1.545 0.763 0 N-CA-C 117.387 2.366 . . . . 0.0 117.387 177.168 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 38.0 mtm -100.06 -56.55 2.34 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 123.848 0.859 . . . . 0.0 112.437 -177.195 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 523' ' ' PHE . . . . . . . . . . . . . 28.6 p90 -167.06 168.18 13.93 Favored 'General case' 0 C--O 1.225 -0.229 0 C-N-CA 127.44 2.296 . . . . 0.0 112.245 -172.279 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 524' ' ' LYS . . . . . 0.424 ' HE2' ' CD2' ' A' ' 548' ' ' LEU . 82.2 mttt -103.1 163.61 12.12 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 121.135 -0.978 . . . . 0.0 111.356 171.331 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 12.0 m -134.26 160.5 41.62 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.813 0 C-N-CA 126.889 2.076 . . . . 0.0 109.331 165.268 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 48.0 tt0 -124.06 128.26 49.07 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-N 119.618 1.099 . . . . 0.0 112.324 170.236 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 527' ' ' ALA . . . . . . . . . . . . . . . -60.62 123.91 18.83 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 124.401 1.081 . . . . 0.0 111.105 178.049 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 76.5 mm-40 -85.39 -37.6 19.68 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 125.448 1.499 . . . . 0.0 111.104 171.103 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 81.3 m-70 -127.63 155.59 43.65 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 127.025 2.13 . . . . 0.0 109.438 176.624 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -82.19 151.29 26.96 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 107.41 -1.33 . . . . 0.0 107.41 178.387 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 94.1 t80 -137.88 113.82 9.89 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 125.099 1.36 . . . . 0.0 113.288 -178.609 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 2.0 m -86.36 118.89 26.09 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 124.405 1.082 . . . . 0.0 113.45 172.696 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -70.22 146.58 50.6 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 124.896 1.278 . . . . 0.0 113.077 -179.864 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 14.5 t -102.01 -31.78 10.48 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 125.314 1.446 . . . . 0.0 113.381 171.111 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 87.2 m-20 -108.08 155.32 20.52 Favored 'General case' 0 N--CA 1.47 0.544 0 N-CA-C 116.808 2.151 . . . . 0.0 116.808 -172.389 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 4.3 t -65.91 -13.3 59.43 Favored 'General case' 0 N--CA 1.483 1.198 0 N-CA-C 116.51 2.041 . . . . 0.0 116.51 -178.547 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . 0.298 63.6 m-20 -113.75 2.53 15.21 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 117.114 2.265 . . . . 0.0 117.114 167.6 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 53.0 mt-10 -74.22 142.84 45.34 Favored 'General case' 0 CA--C 1.541 0.619 0 O-C-N 120.253 -1.53 . . . . 0.0 111.412 167.09 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -89.62 130.98 35.84 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 126.133 1.773 . . . . 0.0 109.643 176.21 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 14.7 tt0 -85.19 131.25 34.46 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 121.677 -0.639 . . . . 0.0 111.422 173.054 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 75.0 mt -121.11 151.1 40.26 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 124.423 1.089 . . . . 0.0 112.631 179.004 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 6.8 tmtt? -116.85 140.57 49.29 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 126.322 1.849 . . . . 0.0 109.753 169.496 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -53.9 106.6 0.2 Allowed 'General case' 0 CA--C 1.548 0.875 0 CA-C-N 119.12 0.873 . . . . 0.0 110.968 175.515 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 114.63 -6.84 22.44 Favored Glycine 0 CA--C 1.538 1.48 0 C-N-CA 125.518 1.533 . . . . 0.0 114.743 -172.943 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -65.5 118.97 10.22 Favored 'General case' 0 CA--C 1.519 -0.227 0 CA-C-N 119.503 1.651 . . . . 0.0 113.723 174.613 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 2.8 t -70.63 134.52 29.9 Favored 'Isoleucine or valine' 0 C--O 1.236 0.352 0 C-N-CA 120.656 -0.418 . . . . 0.0 110.252 159.208 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 1.1 t -123.32 124.47 69.94 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 C-N-CA 125.612 1.565 . . . . 0.0 110.93 175.388 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 548' ' ' LEU . . . . . 0.424 ' CD2' ' HE2' ' A' ' 524' ' ' LYS . 22.2 mt -83.75 99.15 10.08 Favored 'General case' 0 C--N 1.324 -0.541 0 C-N-CA 124.56 1.144 . . . . 0.0 108.216 179.293 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 549' ' ' VAL . . . . . . . . . . . . . 4.1 t -61.57 129.56 24.66 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.109 0 N-CA-C 114.052 1.131 . . . . 0.0 114.052 174.545 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 10.5 pt -124.18 153.73 68.38 Favored Pre-proline 0 CA--C 1.548 0.874 0 C-N-CA 126.44 1.896 . . . . 0.0 110.723 178.233 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -71.17 135.46 27.17 Favored 'Trans proline' 0 CA--C 1.534 0.508 0 C-N-CA 123.91 3.074 . . . . 0.0 111.296 178.56 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 552' ' ' PHE . . . . . 0.442 ' CE1' ' HA ' ' A' ' 558' ' ' GLN . 23.9 m-85 -59.64 138.14 57.82 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 117.664 2.468 . . . . 0.0 117.664 -174.963 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 553' ' ' GLN . . . . . . . . . . . . . 23.6 pt20 -69.67 -24.09 63.56 Favored 'General case' 0 CA--C 1.544 0.726 0 N-CA-C 114.411 1.263 . . . . 0.0 114.411 179.092 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 31.9 m-20 -145.23 149.31 41.09 Favored Pre-proline 0 CA--C 1.543 0.69 0 C-N-CA 125.962 1.705 . . . . 0.0 111.893 178.626 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 555' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_endo -67.85 -39.31 11.57 Favored 'Trans proline' 0 CA--C 1.539 0.753 0 C-N-CA 123.64 2.893 . . . . 0.0 112.68 179.003 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 22.5 pt-20 -70.32 -19.61 63.06 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 124.61 1.164 . . . . 0.0 113.817 176.717 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 557' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -78.32 -21.84 49.01 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 113.462 0.912 . . . . 0.0 113.462 177.098 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 558' ' ' GLN . . . . . 0.442 ' HA ' ' CE1' ' A' ' 552' ' ' PHE . 40.0 tp60 -64.72 146.6 54.54 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 122.154 0.978 . . . . 0.0 111.853 165.534 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . 0.256 6.6 m-20 -141.16 150.66 43.05 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 126.485 1.914 . . . . 0.0 114.525 174.661 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 51.3 tp10 -75.23 127.5 33.33 Favored 'General case' 0 N--CA 1.472 0.64 0 O-C-N 121.013 -1.054 . . . . 0.0 111.06 -173.492 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 82.18 -7.26 64.33 Favored Glycine 0 CA--C 1.538 1.518 0 C-N-CA 124.484 1.04 . . . . 0.0 114.255 -168.874 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 60.8 m95 -98.41 155.57 17.17 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.851 1.261 . . . . 0.0 112.897 178.927 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 6.8 mt -143.55 152.49 41.5 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 125.201 1.401 . . . . 0.0 110.493 176.475 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 55.7 ttm -110.45 140.28 44.85 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 124.275 1.03 . . . . 0.0 112.359 -179.587 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -172.69 -171.69 37.71 Favored Glycine 0 CA--C 1.524 0.641 0 C-N-CA 123.92 0.772 . . . . 0.0 113.237 -179.284 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 11.6 p -131.87 143.2 40.94 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.53 0 C-N-CA 125.131 1.372 . . . . 0.0 110.506 172.375 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 42.0 mtmt -57.94 131.49 50.58 Favored 'General case' 0 N--CA 1.467 0.397 0 O-C-N 121.615 -0.678 . . . . 0.0 111.704 175.08 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -62.49 -40.59 97.19 Favored 'General case' 0 C--O 1.223 -0.325 0 CA-C-O 118.281 -0.866 . . . . 0.0 110.548 176.543 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 26.6 t -58.74 -32.33 69.13 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 119.559 1.072 . . . . 0.0 112.291 177.003 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -76.77 -45.72 27.94 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 114.98 1.474 . . . . 0.0 114.98 177.038 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 56.2 t-105 -67.28 -39.15 85.97 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.85 1.26 . . . . 0.0 112.957 176.492 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 5.0 t-20 -64.17 -28.71 69.94 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 124.894 1.278 . . . . 0.0 111.201 176.061 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 39.4 mt-30 -92.0 7.17 43.42 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.429 1.492 . . . . 0.0 114.614 171.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 89.0 m-70 56.48 34.74 24.83 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 126.432 1.893 . . . . 0.0 114.449 176.508 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 62.2 mttt -73.78 155.77 38.51 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.452 1.101 . . . . 0.0 111.614 174.553 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 12.8 pm0 -57.03 102.93 0.09 Allowed 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 115.403 1.631 . . . . 0.0 115.403 -170.413 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 47.5 tp -53.0 -45.91 68.09 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 125.097 1.359 . . . . 0.0 112.165 -176.697 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 19.5 pt-20 -63.21 -16.14 59.24 Favored 'General case' 0 N--CA 1.479 0.999 0 N-CA-C 115.202 1.556 . . . . 0.0 115.202 -176.889 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 29.0 tptp -114.57 -37.0 4.4 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 125.927 1.691 . . . . 0.0 112.345 -178.987 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 47.9 t -70.23 -30.57 67.67 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.217 1.407 . . . . 0.0 112.885 176.965 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 30.9 ptt85 -60.58 158.64 12.0 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 124.174 0.989 . . . . 0.0 112.839 176.701 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -179.25 175.91 47.47 Favored Glycine 0 N--CA 1.461 0.337 0 CA-C-N 115.966 -0.561 . . . . 0.0 114.375 173.111 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 34.7 m -88.52 140.19 16.19 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 C-N-CA 124.317 1.047 . . . . 0.0 111.149 167.719 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 43.3 p90 -134.44 155.25 79.88 Favored Pre-proline 0 CA--C 1.538 0.503 0 C-N-CA 125.159 1.383 . . . . 0.0 112.565 173.552 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -66.31 113.58 2.72 Favored 'Trans proline' 0 CA--C 1.536 0.617 0 C-N-CA 122.427 2.085 . . . . 0.0 110.451 171.307 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 15.6 pt-20 -60.28 -26.09 66.22 Favored 'General case' 0 N--CA 1.475 0.786 0 O-C-N 121.108 -0.995 . . . . 0.0 112.03 -178.01 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 13.8 p-10 -71.37 -9.21 57.78 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 126.99 2.116 . . . . 0.0 114.444 177.005 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 14.0 m-85 -81.16 -14.09 57.98 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 116.714 2.116 . . . . 0.0 116.714 163.446 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 589' ' ' THR . . . . . . . . . . . . . 54.7 p -126.61 168.85 13.75 Favored 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 125.106 1.362 . . . . 0.0 110.453 -172.766 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -120.66 141.65 50.18 Favored 'General case' 0 N--CA 1.465 0.289 0 C-N-CA 123.489 0.716 . . . . 0.0 109.857 173.912 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.06 130.13 42.24 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 124.412 1.085 . . . . 0.0 109.157 174.732 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 592' ' ' VAL . . . . . . . . . . . . . 4.7 m -121.6 159.2 51.63 Favored Pre-proline 0 N--CA 1.477 0.92 0 C-N-CA 125.186 1.394 . . . . 0.0 108.938 179.446 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 593' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo . . . . . 0 C--O 1.252 1.202 0 C-N-CA 123.968 3.112 . . . . 0.0 114.66 -174.468 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B 1728 ' ' SER . . . . . . . . . . . . . 95.5 p . . . . . 0 N--CA 1.47 0.569 0 CA-C-O 120.444 0.164 . . . . 0.0 110.982 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B 1729 ' ' THR . . . . . . . . . . . . 0.42 1.1 p 63.41 12.43 6.31 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 117.324 2.342 . . . . 0.0 117.324 174.032 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B 1730 ' ' VAL . . . . . . . . . . . . . 3.1 m -73.76 142.81 80.75 Favored Pre-proline 0 N--CA 1.474 0.748 0 C-N-CA 123.494 0.718 . . . . 0.0 112.864 178.709 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 92.9 Cg_endo -75.45 162.92 35.26 Favored 'Trans proline' 0 CA--C 1.54 0.805 0 C-N-CA 122.986 2.458 . . . . 0.0 112.186 172.648 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 51.8 t -137.17 134.0 47.35 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 C-N-CA 125.461 1.504 . . . . 0.0 110.313 177.479 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -68.14 133.0 91.7 Favored Pre-proline 0 CA--C 1.547 0.849 0 CA-C-O 118.237 -0.887 . . . . 0.0 111.608 -175.23 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 3.2 Cg_exo -65.07 166.49 18.56 Favored 'Trans proline' 0 CA--C 1.541 0.839 0 C-N-CA 122.69 2.26 . . . . 0.0 113.221 -178.611 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 36.9 Cg_exo -60.26 160.66 22.32 Favored 'Trans proline' 0 CA--C 1.54 0.778 0 C-N-CA 122.998 2.465 . . . . 0.0 112.364 162.688 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B 1736 ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -131.81 173.83 10.76 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 124.694 1.198 . . . . 0.0 112.116 175.639 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B 1737 ' ' ARG . . . . . . . . . . . . . 51.5 mtt180 -135.4 97.72 3.77 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 126.918 2.087 . . . . 0.0 107.838 177.13 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B 1738 ' ' ARG . . . . . . . . . . . . . 46.5 mtt85 -68.47 160.2 30.21 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-O 121.455 0.645 . . . . 0.0 111.362 -179.841 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B 1739 ' ' ARG . . . . . . . . . . . . . 46.6 ptt85 -84.24 50.05 1.78 Allowed 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 124.845 1.258 . . . . 0.0 112.258 171.421 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B 1740 ' ' GLY . . . . . . . . . . . . . . . 67.06 178.69 10.57 Favored Glycine 0 CA--C 1.538 1.51 0 N-CA-C 111.527 -0.629 . . . . 0.0 111.527 -151.766 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B 1741 ' ' ARG . . . . . . . . . . . . . 77.5 mtm180 -75.39 54.91 0.76 Allowed 'General case' 0 N--CA 1.481 1.092 0 O-C-N 120.869 -1.371 . . . . 0.0 112.335 173.577 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B 1742 ' ' ASN . . . . . . . . . . . . . 70.7 m-80 -117.21 10.44 13.8 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 126.416 1.887 . . . . 0.0 113.358 -172.196 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B 1743 ' ' LEU . . . . . . . . . . . . . 8.0 mp -61.07 148.11 41.51 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 123.815 0.846 . . . . 0.0 109.382 176.57 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B 1744 ' ' THR . . . . . . . . . . . . 0.356 0.2 OUTLIER . . . . . 0 C--O 1.248 1.008 0 N-CA-C 118.032 2.605 . . . . 0.0 118.032 -167.345 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 513' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 1.0 0 N-CA-C 110.854 -0.898 . . . . 0.0 110.854 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 514' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.57 -25.22 0.47 Allowed 'General case' 0 N--CA 1.476 0.837 0 N-CA-C 117.31 2.337 . . . . 0.0 117.31 -169.871 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 9.0 tt 57.71 -45.43 0.05 OUTLIER 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 128.148 2.579 . . . . 0.0 115.865 -166.619 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 516' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -42.71 147.09 0.32 Allowed 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 129.918 3.287 . . . . 0.0 118.394 178.406 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 12.8 mt -131.9 158.28 75.9 Favored Pre-proline 0 CA--C 1.544 0.732 0 C-N-CA 125.567 1.547 . . . . 0.0 113.32 -169.456 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_endo -67.71 160.82 46.49 Favored 'Trans proline' 0 CA--C 1.543 0.97 0 C-N-CA 124.304 3.336 . . . . 0.0 114.622 -172.875 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 66.2 Cg_endo -64.07 133.53 38.77 Favored 'Trans proline' 0 C--N 1.349 0.558 0 C-N-CA 123.267 2.645 . . . . 0.0 110.488 177.56 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 73.8 0.61 55.99 Favored Glycine 0 CA--C 1.535 1.292 0 CA-C-O 117.36 -1.8 . . . . 0.0 115.386 -175.785 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 38.7 t80 -36.59 123.31 0.81 Allowed 'General case' 0 C--N 1.349 0.582 0 CA-C-N 120.717 2.258 . . . . 0.0 116.634 179.823 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 50.1 mtm -94.98 -54.2 3.54 Favored 'General case' 0 N--CA 1.465 0.316 0 C-N-CA 123.252 0.621 . . . . 0.0 111.28 -177.206 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 523' ' ' PHE . . . . . . . . . . . . . 24.9 p90 -167.96 167.16 12.93 Favored 'General case' 0 C--O 1.223 -0.314 0 C-N-CA 126.646 1.978 . . . . 0.0 113.085 -172.685 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 524' ' ' LYS . . . . . 0.448 ' HE2' ' CD2' ' A' ' 548' ' ' LEU . 80.6 mttt -100.26 161.74 13.41 Favored 'General case' 0 C--N 1.326 -0.433 0 O-C-N 121.3 -0.875 . . . . 0.0 111.039 167.616 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 18.0 m -136.86 154.88 32.27 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 C-N-CA 126.742 2.017 . . . . 0.0 108.794 167.833 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 44.6 tt0 -118.68 129.13 55.12 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 119.698 1.135 . . . . 0.0 111.261 173.063 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 527' ' ' ALA . . . . . . . . . . . . . . . -62.72 119.32 9.06 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 124.028 0.931 . . . . 0.0 112.181 -178.444 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 44.7 mm-40 -85.79 -15.31 42.44 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 125.734 1.614 . . . . 0.0 111.932 173.958 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 92.3 m-70 -147.75 156.87 43.2 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 126.067 1.747 . . . . 0.0 111.369 -172.512 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -81.91 124.22 29.54 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 125.416 1.486 . . . . 0.0 114.646 175.957 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 88.4 t80 -129.87 114.56 16.04 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 124.68 1.192 . . . . 0.0 112.333 -177.426 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -83.04 125.63 31.67 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 124.341 1.056 . . . . 0.0 113.425 171.856 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -64.39 137.58 57.97 Favored 'General case' 0 CA--C 1.537 0.474 0 O-C-N 121.293 -0.879 . . . . 0.0 110.48 175.708 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 534' ' ' THR . . . . . . . . . . . . 0.272 2.0 t -132.35 3.53 3.94 Favored 'General case' 0 N--CA 1.473 0.722 0 N-CA-C 115.501 1.667 . . . . 0.0 115.501 -173.211 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -136.09 159.43 41.75 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 126.834 2.054 . . . . 0.0 115.1 165.509 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 1.2 t -61.76 -12.18 15.76 Favored 'General case' 0 N--CA 1.476 0.833 0 N-CA-C 117.143 2.275 . . . . 0.0 117.143 -172.563 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 17.5 p30 -111.91 -0.79 15.69 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 127.716 2.406 . . . . 0.0 116.366 177.866 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 76.7 mt-10 -81.47 144.11 31.59 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 114.437 1.273 . . . . 0.0 114.437 -175.634 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -84.86 152.23 23.73 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 125.825 1.65 . . . . 0.0 109.945 171.133 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -119.3 128.21 53.93 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 125.101 1.36 . . . . 0.0 110.541 -176.734 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 74.4 mt -128.07 146.72 50.6 Favored 'General case' 0 N--CA 1.471 0.575 0 C-N-CA 124.761 1.224 . . . . 0.0 112.25 -168.935 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -120.35 143.46 48.38 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 126.86 2.064 . . . . 0.0 109.404 173.232 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -55.77 99.69 0.03 OUTLIER 'General case' 0 CA--C 1.552 1.021 0 CA-C-N 119.619 1.099 . . . . 0.0 112.533 178.889 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 125.99 -7.22 7.73 Favored Glycine 0 CA--C 1.537 1.461 0 C-N-CA 126.545 2.021 . . . . 0.0 115.174 -173.728 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 80.4 m-20 -73.04 121.75 20.65 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-N 120.18 1.99 . . . . 0.0 114.223 -177.609 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 4.1 t -73.36 133.99 30.6 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 CA-C-N 119.386 0.994 . . . . 0.0 111.373 165.306 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 1.4 t -119.74 124.63 73.19 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.516 0 C-N-CA 126.173 1.789 . . . . 0.0 111.048 172.492 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 548' ' ' LEU . . . . . 0.448 ' CD2' ' HE2' ' A' ' 524' ' ' LYS . 22.5 mt -80.28 98.63 7.49 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 174.637 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 549' ' ' VAL . . . . . . . . . . . . . 4.1 t -62.95 130.4 27.52 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 N-CA-C 114.449 1.277 . . . . 0.0 114.449 174.283 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 20.9 pt -127.3 157.65 71.9 Favored Pre-proline 0 CA--C 1.546 0.805 0 C-N-CA 127.034 2.134 . . . . 0.0 109.838 177.73 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo -71.05 154.27 62.64 Favored 'Trans proline' 0 CA--C 1.54 0.789 0 C-N-CA 123.358 2.705 . . . . 0.0 112.431 174.565 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 43.5 m-85 -67.1 155.79 37.82 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 116.855 2.168 . . . . 0.0 116.855 177.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 553' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -65.96 -21.01 66.39 Favored 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 114.653 1.353 . . . . 0.0 114.653 -178.666 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 4.0 t30 -160.94 151.2 14.73 Favored Pre-proline 0 CA--C 1.545 0.787 0 C-N-CA 126.114 1.766 . . . . 0.0 107.963 178.338 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 555' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -68.47 -30.93 28.56 Favored 'Trans proline' 0 CA--C 1.536 0.611 0 C-N-CA 123.839 3.026 . . . . 0.0 112.567 -175.741 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 17.6 pt-20 -90.55 -11.63 39.53 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 114.347 1.239 . . . . 0.0 114.347 -179.632 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 557' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.94 -26.94 43.58 Favored 'General case' 0 CA--C 1.543 0.679 0 O-C-N 121.631 -0.668 . . . . 0.0 111.831 171.719 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 40.6 tt0 -60.81 120.52 10.28 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 126.048 1.739 . . . . 0.0 113.995 -177.607 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -85.49 131.28 34.4 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.175 1.39 . . . . 0.0 109.158 -177.867 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 73.6 tt0 -60.66 130.74 48.01 Favored 'General case' 0 N--CA 1.472 0.654 0 O-C-N 121.014 -1.054 . . . . 0.0 111.68 178.023 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 84.89 -12.02 58.45 Favored Glycine 0 CA--C 1.532 1.148 0 C-N-CA 124.833 1.206 . . . . 0.0 114.966 -178.7 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 48.6 m95 -91.48 155.48 18.39 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 124.664 1.186 . . . . 0.0 113.048 178.98 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 14.1 mt -126.76 151.94 47.54 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 124.038 0.935 . . . . 0.0 110.455 170.345 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 56.5 ttm -109.84 143.4 39.78 Favored 'General case' 0 N--CA 1.464 0.243 0 C-N-CA 124.179 0.992 . . . . 0.0 111.003 174.842 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -170.9 -172.9 37.61 Favored Glycine 0 CA--C 1.524 0.597 0 C-N-CA 123.888 0.756 . . . . 0.0 112.765 177.898 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 14.1 p -133.63 139.61 48.44 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.487 0 C-N-CA 125.232 1.413 . . . . 0.0 108.79 170.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 36.4 mtmt -58.49 136.68 57.58 Favored 'General case' 0 N--CA 1.467 0.418 0 O-C-N 121.215 -0.928 . . . . 0.0 111.16 175.71 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 19.6 tt0 -61.73 -40.74 96.17 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 118.281 -0.866 . . . . 0.0 110.876 179.436 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 34.3 m -61.38 -35.62 77.99 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 119.456 1.025 . . . . 0.0 112.663 176.48 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 67.1 m-20 -68.34 -46.62 69.66 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 125.742 1.617 . . . . 0.0 115.067 174.351 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 53.4 t-105 -66.94 -33.63 76.0 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 124.315 1.046 . . . . 0.0 112.242 174.532 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 4.2 t-20 -73.35 -23.7 60.25 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.273 1.429 . . . . 0.0 112.672 172.097 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 38.3 mt-30 -77.17 0.25 22.46 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 125.046 1.338 . . . . 0.0 113.399 168.279 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 91.9 m-70 62.18 31.71 17.55 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.442 1.497 . . . . 0.0 113.483 172.94 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 79.1 mttt -76.72 157.58 31.61 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 126.046 1.738 . . . . 0.0 112.083 177.176 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -62.23 113.47 2.9 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 124.348 1.059 . . . . 0.0 113.145 174.426 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 59.6 tp -56.32 -42.74 78.14 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.465 1.506 . . . . 0.0 112.046 -178.814 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 23.9 pt-20 -68.95 -8.36 43.79 Favored 'General case' 0 N--CA 1.477 0.88 0 N-CA-C 115.06 1.504 . . . . 0.0 115.06 -173.778 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 34.8 mmtp -111.72 -41.35 4.07 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 124.72 1.208 . . . . 0.0 111.778 166.78 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 96.6 m -76.49 -17.47 59.27 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 115.059 1.503 . . . . 0.0 115.059 -172.18 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 20.4 ptt180 -65.13 163.85 14.22 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 125.011 1.324 . . . . 0.0 112.629 169.279 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -167.11 174.18 42.36 Favored Glycine 0 CA--C 1.526 0.754 0 CA-C-N 114.734 -1.121 . . . . 0.0 113.985 169.542 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 31.5 m -93.55 140.83 15.74 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.594 0 C-N-CA 124.748 1.219 . . . . 0.0 110.705 168.333 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 40.9 p90 -138.02 156.54 74.03 Favored Pre-proline 0 CA--C 1.543 0.684 0 C-N-CA 124.274 1.03 . . . . 0.0 113.245 177.291 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -66.97 111.89 2.33 Favored 'Trans proline' 0 CA--C 1.535 0.571 0 C-N-CA 122.629 2.219 . . . . 0.0 110.169 170.015 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 22.1 pt-20 -56.22 -29.83 61.51 Favored 'General case' 0 N--CA 1.475 0.821 0 O-C-N 121.309 -0.87 . . . . 0.0 112.5 -178.72 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 13.0 p-10 -69.2 -14.14 62.8 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 127.019 2.127 . . . . 0.0 113.867 -179.587 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 18.8 m-85 -75.21 -8.86 57.78 Favored 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 116.952 2.205 . . . . 0.0 116.952 164.64 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 589' ' ' THR . . . . . . . . . . . . . 70.0 p -130.3 168.48 16.82 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 125.39 1.476 . . . . 0.0 111.827 -173.387 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -124.52 137.86 54.38 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 123.93 0.892 . . . . 0.0 109.791 173.422 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.93 137.85 56.36 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 124.712 1.205 . . . . 0.0 110.549 174.871 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 592' ' ' VAL . . . . . . . . . . . . . 2.7 m -130.18 162.52 53.62 Favored Pre-proline 0 N--CA 1.48 1.029 0 C-N-CA 125.623 1.569 . . . . 0.0 109.601 178.322 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 593' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo . . . . . 0 C--O 1.255 1.338 0 C-N-CA 124.626 3.551 . . . . 0.0 115.067 -178.714 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B 1728 ' ' SER . . . . . . . . . . . . . 58.5 p . . . . . 0 N--CA 1.474 0.75 0 CA-C-O 118.626 -0.702 . . . . 0.0 112.213 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B 1729 ' ' THR . . . . . . . . . . . . 0.276 1.3 p -123.88 -17.4 6.32 Favored 'General case' 0 N--CA 1.481 1.125 0 N-CA-C 117.293 2.331 . . . . 0.0 117.293 -176.78 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B 1730 ' ' VAL . . . . . . . . . . . . . 2.5 m -94.67 148.19 34.45 Favored Pre-proline 0 N--CA 1.479 1.008 0 N-CA-C 114.138 1.162 . . . . 0.0 114.138 179.085 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -77.98 169.79 19.91 Favored 'Trans proline' 0 CA--C 1.541 0.847 0 C-N-CA 124.366 3.377 . . . . 0.0 113.535 174.57 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 90.6 t -131.93 136.8 56.18 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.854 0 C-N-CA 126.559 1.944 . . . . 0.0 108.431 173.629 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -62.34 139.04 96.41 Favored Pre-proline 0 CA--C 1.547 0.864 0 O-C-N 121.78 -0.575 . . . . 0.0 111.952 -177.344 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -69.04 161.36 46.15 Favored 'Trans proline' 0 CA--C 1.539 0.738 0 C-N-CA 121.976 1.784 . . . . 0.0 110.587 177.995 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 46.9 Cg_exo -55.78 153.68 29.53 Favored 'Trans proline' 0 N--CA 1.459 -0.51 0 C-N-CA 122.227 1.952 . . . . 0.0 111.95 176.194 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B 1736 ' ' ARG . . . . . . . . . . . . . 80.1 mtp180 -104.96 146.0 29.64 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 123.817 0.847 . . . . 0.0 110.505 164.456 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B 1737 ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -165.55 176.62 8.0 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 125.281 1.432 . . . . 0.0 113.065 -152.196 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B 1738 ' ' ARG . . . . . . . . . . . . . 62.2 ttt180 69.58 -38.79 0.41 Allowed 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 128.97 2.908 . . . . 0.0 117.475 170.546 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B 1739 ' ' ARG . . . . . . . . . . . . . 81.5 mtm180 -64.68 132.8 50.69 Favored 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 115.42 1.637 . . . . 0.0 115.42 -162.205 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B 1740 ' ' GLY . . . . . . . . . . . . . . . 83.85 -158.95 35.65 Favored Glycine 0 CA--C 1.532 1.105 0 N-CA-C 114.895 0.718 . . . . 0.0 114.895 165.401 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B 1741 ' ' ARG . . . . . . . . . . . . . 24.2 ttm105 56.28 55.7 6.44 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 125.97 1.708 . . . . 0.0 112.637 -175.471 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B 1742 ' ' ASN . . . . . . . . . . . . . 51.5 t30 -74.62 -32.5 62.34 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.475 1.11 . . . . 0.0 112.096 175.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B 1743 ' ' LEU . . . . . . . . . . . . . 4.2 mm? -104.88 160.83 14.7 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.975 1.31 . . . . 0.0 111.487 178.685 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B 1744 ' ' THR . . . . . . . . . . . . 0.289 5.8 p . . . . . 0 C--O 1.255 1.345 0 C-N-CA 125.172 1.389 . . . . 0.0 113.714 169.789 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 513' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.946 0 N-CA-C 111.103 -0.799 . . . . 0.0 111.103 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 514' ' ' ARG . . . . . . . . . . . . . 12.6 ptm180 -144.25 169.62 17.55 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 125.657 1.583 . . . . 0.0 110.074 177.913 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -120.34 -35.48 3.42 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 124.737 1.215 . . . . 0.0 111.311 -179.458 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 516' ' ' ASP . . . . . . . . . . . . . 48.2 t0 -67.23 140.91 57.42 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 125.401 1.48 . . . . 0.0 111.737 -179.928 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 13.2 mt -116.9 162.12 28.99 Favored Pre-proline 0 CA--C 1.543 0.676 0 C-N-CA 127.305 2.242 . . . . 0.0 111.404 -172.369 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_endo -66.99 162.33 38.57 Favored 'Trans proline' 0 CA--C 1.538 0.718 0 C-N-CA 123.436 2.757 . . . . 0.0 114.776 -171.245 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -56.78 128.58 30.55 Favored 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 123.793 2.996 . . . . 0.0 111.077 176.536 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 73.9 2.26 61.04 Favored Glycine 0 CA--C 1.535 1.311 0 CA-C-O 116.956 -2.024 . . . . 0.0 116.384 -176.851 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 35.7 t80 -38.48 127.54 1.44 Allowed 'General case' 0 C--N 1.349 0.563 0 CA-C-N 121.053 2.427 . . . . 0.0 116.909 -175.741 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 48.8 mtm -104.25 -53.17 2.78 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 123.631 0.772 . . . . 0.0 112.116 -176.911 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 523' ' ' PHE . . . . . . . . . . . . . 25.6 p90 -166.58 172.29 10.86 Favored 'General case' 0 N--CA 1.465 0.322 0 C-N-CA 125.775 1.63 . . . . 0.0 113.181 -174.539 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 524' ' ' LYS . . . . . 0.536 ' HE2' ' CD2' ' A' ' 548' ' ' LEU . 78.3 mttt -104.52 164.8 11.49 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 121.214 -0.929 . . . . 0.0 112.446 170.369 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 14.6 m -133.85 161.92 40.22 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 126.686 1.995 . . . . 0.0 109.383 164.688 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 33.1 tt0 -125.44 130.01 50.98 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-N 118.929 0.786 . . . . 0.0 111.919 168.703 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 527' ' ' ALA . . . . . . . . . . . . . . . -62.28 127.25 30.48 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.098 0.959 . . . . 0.0 111.518 178.613 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 40.1 mm-40 -88.66 -29.05 20.21 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 125.409 1.483 . . . . 0.0 110.813 170.634 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 97.5 m-70 -137.34 157.19 47.15 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 126.13 1.772 . . . . 0.0 111.518 -176.198 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 14.8 p-10 -83.12 131.6 35.13 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 114.908 1.447 . . . . 0.0 114.908 178.085 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 78.0 t80 -133.75 116.5 15.82 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.337 1.055 . . . . 0.0 112.356 -172.335 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 2.3 m -83.77 125.61 32.09 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 114.947 1.462 . . . . 0.0 114.947 176.657 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -71.67 142.49 49.88 Favored 'General case' 0 CA--C 1.538 0.508 0 O-C-N 121.459 -0.775 . . . . 0.0 111.702 172.634 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 2.9 t -138.44 -4.59 1.64 Allowed 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 126.476 1.91 . . . . 0.0 115.78 -175.845 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 19.6 m-20 -119.53 155.04 32.92 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 127.138 2.175 . . . . 0.0 116.018 164.082 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 5.6 t -55.75 -22.63 25.05 Favored 'General case' 0 N--CA 1.477 0.911 0 N-CA-C 116.62 2.081 . . . . 0.0 116.62 -179.628 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 70.1 m-20 -99.05 -8.14 25.75 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 115.622 1.712 . . . . 0.0 115.622 177.337 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 11.8 mt-10 -74.52 157.07 36.14 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 114.89 1.441 . . . . 0.0 114.89 -177.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -103.7 137.37 41.83 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 127.807 2.443 . . . . 0.0 111.147 173.808 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 33.4 tt0 -94.12 121.73 35.92 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.955 1.302 . . . . 0.0 111.512 176.443 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 71.2 mt -118.52 148.18 42.89 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.645 1.178 . . . . 0.0 113.076 -177.429 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 5.9 tppt? -112.25 145.04 40.65 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 127.245 2.218 . . . . 0.0 110.296 166.294 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -56.46 104.04 0.13 Allowed 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.694 0.798 . . . . 0.0 110.565 172.237 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 121.18 -9.45 10.24 Favored Glycine 0 CA--C 1.535 1.305 0 C-N-CA 125.925 1.726 . . . . 0.0 114.736 -173.183 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 88.7 m-20 -70.56 124.9 25.35 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 119.854 1.827 . . . . 0.0 114.945 -178.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 2.4 t -74.65 136.54 24.95 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 CA-C-N 118.313 0.506 . . . . 0.0 111.615 165.333 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 1.2 t -128.55 121.4 55.03 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 C-N-CA 124.69 1.196 . . . . 0.0 111.703 176.523 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 548' ' ' LEU . . . . . 0.536 ' CD2' ' HE2' ' A' ' 524' ' ' LYS . 17.2 mt -77.83 100.54 6.36 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.697 1.199 . . . . 0.0 108.533 175.792 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 549' ' ' VAL . . . . . . . . . . . . . 7.2 t -61.42 130.24 25.3 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.966 0 N-CA-C 113.945 1.091 . . . . 0.0 113.945 173.118 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 8.3 pt -127.61 156.76 74.91 Favored Pre-proline 0 CA--C 1.542 0.659 0 C-N-CA 126.443 1.897 . . . . 0.0 109.564 178.102 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 80.0 Cg_endo -70.78 154.19 63.85 Favored 'Trans proline' 0 CA--C 1.538 0.715 0 C-N-CA 123.016 2.477 . . . . 0.0 111.523 171.083 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 33.1 m-85 -65.32 156.96 30.42 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 115.581 1.697 . . . . 0.0 115.581 172.02 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 553' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -65.38 -25.93 67.79 Favored 'General case' 0 CA--C 1.546 0.798 0 N-CA-C 113.115 0.783 . . . . 0.0 113.115 169.956 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 20.6 m-80 -146.92 148.27 32.18 Favored Pre-proline 0 CA--C 1.544 0.738 0 C-N-CA 125.963 1.705 . . . . 0.0 112.516 175.347 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 555' ' ' PRO . . . . . . . . . . . . . 92.9 Cg_endo -70.77 -30.12 18.05 Favored 'Trans proline' 0 CA--C 1.539 0.747 0 C-N-CA 123.91 3.073 . . . . 0.0 113.199 178.787 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 -76.85 -25.33 53.02 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 113.578 0.955 . . . . 0.0 113.578 174.711 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 557' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -74.26 -23.12 59.09 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 123.971 0.908 . . . . 0.0 112.954 177.229 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 38.4 tt0 -64.03 136.83 57.64 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 125.7 1.6 . . . . 0.0 113.184 174.166 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -114.85 137.36 52.05 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 126.657 1.983 . . . . 0.0 113.757 -176.848 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 39.8 tp10 -74.39 133.95 42.45 Favored 'General case' 0 N--CA 1.474 0.744 0 O-C-N 120.406 -1.434 . . . . 0.0 112.664 -168.847 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 84.36 -8.1 69.43 Favored Glycine 0 CA--C 1.536 1.359 0 C-N-CA 125.412 1.482 . . . . 0.0 114.264 -173.4 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 60.2 m95 -92.58 161.41 14.6 Favored 'General case' 0 C--O 1.235 0.291 0 C-N-CA 125.389 1.476 . . . . 0.0 112.642 175.547 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 13.9 mt -132.99 152.15 51.99 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 124.815 1.246 . . . . 0.0 109.603 166.267 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 39.4 tpp -106.68 140.23 39.87 Favored 'General case' 0 N--CA 1.465 0.275 0 C-N-CA 124.46 1.104 . . . . 0.0 110.389 171.732 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -165.33 -172.72 33.1 Favored Glycine 0 CA--C 1.523 0.564 0 CA-C-O 122.191 0.884 . . . . 0.0 113.395 174.376 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 12.7 p -130.15 137.92 55.22 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.383 0 C-N-CA 125.386 1.474 . . . . 0.0 108.816 169.433 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 29.4 mtmt -56.82 134.19 54.99 Favored 'General case' 0 N--CA 1.465 0.303 0 O-C-N 121.406 -0.809 . . . . 0.0 110.917 175.49 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -61.41 -38.75 88.22 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-O 118.993 -0.527 . . . . 0.0 111.042 177.686 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 10.8 t -66.07 -35.0 79.36 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 119.439 1.018 . . . . 0.0 112.246 175.5 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 -59.15 -51.11 71.44 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 114.024 1.12 . . . . 0.0 114.024 168.53 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 61.9 t-105 -69.66 -32.54 71.24 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.685 1.594 . . . . 0.0 113.286 -178.817 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 12.3 t-20 -78.95 -18.38 53.86 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 125.315 1.446 . . . . 0.0 112.607 173.949 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 8.8 mm100 -90.08 5.26 47.49 Favored 'General case' 0 CA--C 1.546 0.822 0 CA-C-N 119.333 0.969 . . . . 0.0 113.514 163.509 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 83.8 m-70 61.85 25.81 15.56 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 126.367 1.867 . . . . 0.0 114.623 172.145 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 78.4 mttt -68.24 155.29 40.0 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 125.448 1.499 . . . . 0.0 111.489 177.28 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 6.9 pm0 -64.53 104.78 0.84 Allowed 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 114.295 1.22 . . . . 0.0 114.295 -169.133 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 56.1 tp -51.91 -45.06 64.09 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.348 1.059 . . . . 0.0 113.266 -173.961 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -66.28 -19.73 65.9 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 114.334 1.235 . . . . 0.0 114.334 -174.171 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 14.6 mmmm -100.37 -41.02 7.2 Favored 'General case' 0 N--CA 1.481 1.111 0 CA-C-N 119.104 0.865 . . . . 0.0 112.208 164.465 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 91.0 m -71.59 -23.61 61.76 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 114.979 1.474 . . . . 0.0 114.979 -169.733 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 38.0 ptt180 -62.38 166.03 5.47 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 125.097 1.359 . . . . 0.0 112.293 172.03 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -176.92 169.45 41.84 Favored Glycine 0 CA--C 1.522 0.509 0 N-CA-C 114.888 0.715 . . . . 0.0 114.888 172.583 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 31.6 m -86.06 145.71 7.42 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.213 0 C-N-CA 123.817 0.847 . . . . 0.0 110.872 170.909 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 47.8 p90 -142.96 155.07 62.62 Favored Pre-proline 0 CA--C 1.545 0.752 0 C-N-CA 125.426 1.49 . . . . 0.0 112.186 174.831 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -68.19 113.61 3.13 Favored 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.361 2.04 . . . . 0.0 109.703 171.441 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 20.2 pt-20 -58.6 -26.47 63.7 Favored 'General case' 0 N--CA 1.475 0.805 0 O-C-N 121.269 -0.894 . . . . 0.0 112.497 -177.668 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 9.0 p-10 -68.77 -16.2 63.73 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 126.503 1.921 . . . . 0.0 114.435 176.73 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 19.0 m-85 -72.78 -14.1 61.46 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 116.749 2.129 . . . . 0.0 116.749 162.008 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 589' ' ' THR . . . . . . . . . . . . . 64.1 p -124.27 177.27 5.94 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 126.173 1.789 . . . . 0.0 110.957 -176.261 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 16.8 pt-20 -131.62 138.57 48.85 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.511 0.724 . . . . 0.0 110.368 170.35 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -70.85 111.75 6.51 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 125.465 1.506 . . . . 0.0 109.849 -177.511 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 592' ' ' VAL . . . . . . . . . . . . . 2.6 m -94.19 159.66 33.66 Favored Pre-proline 0 N--CA 1.479 1.014 0 C-N-CA 124.78 1.232 . . . . 0.0 109.428 -178.688 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 593' ' ' PRO . . . . . . . . . . . . . 92.4 Cg_endo . . . . . 0 C--O 1.249 1.068 0 C-N-CA 124.24 3.293 . . . . 0.0 114.326 -176.71 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B 1728 ' ' SER . . . . . . . . . . . . . 21.9 t . . . . . 0 N--CA 1.474 0.768 0 CA-C-O 120.743 0.306 . . . . 0.0 110.87 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B 1729 ' ' THR . . . . . . . . . . . . 0.254 0.9 OUTLIER -130.26 -8.96 4.25 Favored 'General case' 0 N--CA 1.482 1.152 0 N-CA-C 117.023 2.231 . . . . 0.0 117.023 176.894 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B 1730 ' ' VAL . . . . . . . . . . . . . 4.3 m -58.69 155.17 31.62 Favored Pre-proline 0 N--CA 1.479 0.975 0 C-N-CA 125.448 1.499 . . . . 0.0 113.23 -179.933 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 39.0 Cg_endo -60.6 160.33 24.76 Favored 'Trans proline' 0 C--N 1.35 0.613 0 C-N-CA 123.057 2.505 . . . . 0.0 113.651 -177.467 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 19.9 t -132.64 125.36 52.85 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 125.337 1.455 . . . . 0.0 111.445 -178.324 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -66.04 141.11 97.33 Favored Pre-proline 0 CA--C 1.547 0.853 0 C-N-CA 123.639 0.776 . . . . 0.0 113.035 -174.443 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -72.7 167.17 27.88 Favored 'Trans proline' 0 CA--C 1.547 1.149 0 C-N-CA 122.415 2.076 . . . . 0.0 112.579 175.557 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -60.04 153.98 54.28 Favored 'Trans proline' 0 CA--C 1.536 0.608 0 C-N-CA 123.097 2.531 . . . . 0.0 113.244 174.495 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B 1736 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.45 154.2 42.36 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 124.743 1.217 . . . . 0.0 110.714 174.2 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B 1737 ' ' ARG . . . . . . . . . . . . . 32.1 mmt180 -130.84 129.73 42.72 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 125.665 1.586 . . . . 0.0 110.188 -169.694 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B 1738 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.12 130.61 40.65 Favored 'General case' 0 N--CA 1.478 0.956 0 CA-C-N 119.031 0.832 . . . . 0.0 112.604 176.734 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B 1739 ' ' ARG . . . . . . . . . . . . . 11.3 mmt-85 -158.38 151.0 22.16 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 127.396 2.279 . . . . 0.0 111.214 172.383 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B 1740 ' ' GLY . . . . . . . . . . . . . . . 82.66 152.65 11.37 Favored Glycine 0 CA--C 1.537 1.425 0 O-C-N 124.09 0.869 . . . . 0.0 113.211 175.198 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B 1741 ' ' ARG . . . . . . . . . . . . . 10.2 tpt180 -55.22 139.94 40.56 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 125.276 1.43 . . . . 0.0 113.177 -164.249 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B 1742 ' ' ASN . . . . . . . . . . . . . 20.4 p30 -140.25 -13.39 1.04 Allowed 'General case' 0 CA--C 1.55 0.947 0 N-CA-C 116.685 2.106 . . . . 0.0 116.685 179.682 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B 1743 ' ' LEU . . . . . . . . . . . . . 63.3 tp -54.24 121.49 8.31 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 125.273 1.429 . . . . 0.0 113.246 -175.692 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B 1744 ' ' THR . . . . . . . . . . . . 0.313 1.2 t . . . . . 0 C--O 1.254 1.319 0 N-CA-C 116.877 2.177 . . . . 0.0 116.877 -172.087 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 517' ' ' LEU . . . . . 0.492 HD22 HD22 ' A' ' 548' ' ' LEU . 14.1 mt . . . . . 0 CA--C 1.543 0.703 0 N-CA-C 112.23 0.456 . . . . 0.0 112.23 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -66.5 160.53 45.38 Favored 'Trans proline' 0 CA--C 1.537 0.631 0 C-N-CA 123.408 2.739 . . . . 0.0 113.401 -174.46 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 44.6 Cg_endo -59.05 133.15 51.43 Favored 'Trans proline' 0 N--CA 1.458 -0.564 0 C-N-CA 123.155 2.57 . . . . 0.0 110.656 -177.918 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 70.57 2.45 43.41 Favored Glycine 0 CA--C 1.537 1.451 0 CA-C-O 117.422 -1.765 . . . . 0.0 116.378 -178.803 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 19.6 t80 -34.6 131.61 0.34 Allowed 'General case' 0 CA--C 1.543 0.711 0 N-CA-C 117.76 2.504 . . . . 0.0 117.76 179.733 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 52.8 mtm -100.38 -57.02 2.21 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 -176.379 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 523' ' ' PHE . . . . . 0.481 ' CE1' HG21 ' A' ' 549' ' ' VAL . 32.7 p90 -167.58 173.7 8.38 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 127.963 2.505 . . . . 0.0 110.848 -176.093 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 524' ' ' LYS . . . . . 0.507 ' HE2' ' CD2' ' A' ' 548' ' ' LEU . 85.3 mttt -106.34 160.31 15.47 Favored 'General case' 0 N--CA 1.47 0.558 0 O-C-N 121.212 -0.93 . . . . 0.0 111.22 172.358 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 15.5 m -130.24 161.28 40.3 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 C-N-CA 126.184 1.794 . . . . 0.0 109.39 165.377 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 26.9 tt0 -127.41 128.83 46.46 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 119.541 1.064 . . . . 0.0 111.803 172.001 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 527' ' ' ALA . . . . . 0.407 ' HA ' HG22 ' A' ' 589' ' ' THR . . . -60.99 127.98 34.2 Favored 'General case' 0 CA--C 1.538 0.494 0 O-C-N 121.188 -0.945 . . . . 0.0 111.288 179.566 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 29.3 mm-40 -94.43 -25.75 16.78 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.49 1.516 . . . . 0.0 111.237 173.261 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 77.3 m-70 -135.66 162.9 31.43 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 127.444 2.298 . . . . 0.0 109.367 -178.652 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -90.51 143.31 26.87 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 121.117 -0.989 . . . . 0.0 113.29 177.958 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 89.6 t80 -136.25 125.29 24.37 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.978 1.311 . . . . 0.0 114.054 -177.982 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 3.5 m -96.92 120.64 37.64 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 113.785 1.032 . . . . 0.0 113.785 174.107 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -65.54 116.94 7.32 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-O 121.541 0.686 . . . . 0.0 111.901 -176.952 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 13.1 t -81.46 -28.54 34.11 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 123.897 0.879 . . . . 0.0 113.27 -173.82 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -140.36 176.72 8.54 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 116.268 1.951 . . . . 0.0 116.268 -165.343 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 536' ' ' THR . . . . . . . . . . . . 0.305 0.6 OUTLIER -75.84 -5.53 46.42 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 118.86 2.911 . . . . 0.0 118.86 -162.333 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . 0.389 1.6 p-10 -110.39 -10.22 14.59 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 115.832 1.79 . . . . 0.0 115.832 165.787 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 30.4 mp0 -80.4 145.2 32.11 Favored 'General case' 0 CA--C 1.557 1.238 0 N-CA-C 114.798 1.407 . . . . 0.0 114.798 -167.777 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -97.76 138.35 35.25 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 129.303 3.041 . . . . 0.0 110.699 -177.561 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 20.4 tt0 -90.49 135.0 33.97 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 123.958 0.903 . . . . 0.0 112.354 175.032 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 80.0 mt -126.75 145.75 50.49 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 125.159 1.384 . . . . 0.0 112.469 -179.691 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 9.9 tmtt? -112.32 141.2 46.33 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 125.34 1.456 . . . . 0.0 108.803 167.362 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -52.11 109.84 0.42 Allowed 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 118.888 0.767 . . . . 0.0 110.748 174.179 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 115.9 -8.81 18.91 Favored Glycine 0 CA--C 1.535 1.295 0 C-N-CA 125.797 1.665 . . . . 0.0 114.807 -174.651 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 64.5 m-20 -72.47 121.11 19.04 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 119.959 1.88 . . . . 0.0 114.279 -179.48 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 6.5 t -71.48 135.52 27.77 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 CA-C-N 118.688 0.676 . . . . 0.0 110.404 164.886 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -123.53 123.77 68.11 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.489 0 C-N-CA 125.813 1.645 . . . . 0.0 110.828 174.839 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 548' ' ' LEU . . . . . 0.507 ' CD2' ' HE2' ' A' ' 524' ' ' LYS . 21.6 mt -81.11 100.63 9.14 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 108.118 -1.067 . . . . 0.0 108.118 179.148 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 549' ' ' VAL . . . . . 0.481 HG21 ' CE1' ' A' ' 523' ' ' PHE . 5.7 t -60.43 130.02 23.72 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.166 0 N-CA-C 113.811 1.041 . . . . 0.0 113.811 174.31 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 10.2 pt -127.37 157.47 72.6 Favored Pre-proline 0 CA--C 1.549 0.936 0 C-N-CA 126.77 2.028 . . . . 0.0 110.514 177.263 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_endo -74.58 151.28 41.56 Favored 'Trans proline' 0 CA--C 1.54 0.812 0 C-N-CA 123.813 3.009 . . . . 0.0 111.729 172.402 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 552' ' ' PHE . . . . . 0.403 ' CE2' ' HA ' ' A' ' 558' ' ' GLN . 42.0 m-85 . . . . . 0 CA--C 1.539 0.523 0 N-CA-C 118.013 2.597 . . . . 0.0 118.013 -177.379 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 558' ' ' GLN . . . . . 0.403 ' HA ' ' CE2' ' A' ' 552' ' ' PHE . 33.9 tt0 . . . . . 0 C--O 1.235 0.321 0 CA-C-O 122.731 1.253 . . . . 0.0 111.739 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . 0.254 48.7 m-20 -71.82 139.21 48.84 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 125.587 1.555 . . . . 0.0 114.427 174.395 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -70.18 124.6 24.52 Favored 'General case' 0 CA--C 1.541 0.629 0 O-C-N 120.754 -1.216 . . . . 0.0 110.944 -174.046 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 84.79 1.08 89.11 Favored Glycine 0 CA--C 1.54 1.595 0 N-CA-C 115.089 0.796 . . . . 0.0 115.089 -171.536 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 46.4 m95 -102.34 163.76 12.05 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 125.194 1.398 . . . . 0.0 113.554 179.564 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 14.5 mt -132.89 150.59 52.15 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 125.724 1.609 . . . . 0.0 109.856 170.155 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 54.8 ttm -106.12 140.57 38.88 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 124.208 1.003 . . . . 0.0 112.03 170.017 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -166.17 -172.57 33.66 Favored Glycine 0 CA--C 1.522 0.52 0 C-N-CA 124.37 0.986 . . . . 0.0 112.797 173.748 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 14.5 p -130.35 140.99 47.44 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.551 0 C-N-CA 125.405 1.482 . . . . 0.0 108.9 169.473 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 39.8 mtmt -58.6 136.24 57.56 Favored 'General case' 0 CA--C 1.52 -0.174 0 O-C-N 121.53 -0.731 . . . . 0.0 111.44 176.489 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -60.63 -40.89 93.59 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 117.663 -1.16 . . . . 0.0 111.783 -178.74 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 57.4 m -68.84 -35.59 77.14 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 120.52 1.509 . . . . 0.0 111.878 176.649 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -58.59 -33.11 69.62 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 114.05 1.129 . . . . 0.0 114.05 171.793 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 62.9 t-105 -84.77 -34.48 22.79 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.798 1.639 . . . . 0.0 113.888 174.709 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 7.8 t-20 -71.42 -22.0 61.91 Favored 'General case' 0 CA--C 1.552 1.023 0 C-N-CA 126.671 1.989 . . . . 0.0 111.984 175.006 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 41.4 mt-30 -85.55 -5.76 59.25 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 126.266 1.826 . . . . 0.0 113.04 167.083 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 21.7 m-70 58.49 38.38 25.53 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 127.392 2.277 . . . . 0.0 113.255 172.86 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 71.9 mttt -75.14 166.06 24.25 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 126.33 1.852 . . . . 0.0 112.476 177.99 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 3.2 pm0 -51.25 96.73 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 126.043 1.737 . . . . 0.0 114.644 177.685 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 42.8 tp -55.7 -49.32 73.32 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 126.057 1.743 . . . . 0.0 112.448 -170.079 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 64.0 mt-10 -67.73 -13.08 61.81 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 114.521 1.304 . . . . 0.0 114.521 -176.142 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 43.7 mmtm -105.18 -25.13 12.6 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 125.569 1.548 . . . . 0.0 112.898 172.466 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 90.3 m -82.61 -28.18 30.98 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 114.117 1.154 . . . . 0.0 114.117 178.109 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 36.4 ptt180 -70.24 161.65 29.91 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 124.454 1.102 . . . . 0.0 112.917 176.99 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -173.91 174.79 46.41 Favored Glycine 0 N--CA 1.468 0.812 0 C-N-CA 124.651 1.12 . . . . 0.0 114.493 176.526 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 13.1 m -93.27 137.33 22.77 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 C-N-CA 125.065 1.346 . . . . 0.0 112.7 172.033 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 39.8 p90 -132.33 155.68 80.99 Favored Pre-proline 0 CA--C 1.539 0.553 0 C-N-CA 125.098 1.359 . . . . 0.0 114.004 178.004 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 62.6 Cg_endo -66.75 107.82 1.34 Allowed 'Trans proline' 0 N--CA 1.458 -0.616 0 C-N-CA 122.49 2.127 . . . . 0.0 109.87 168.813 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 17.6 pt-20 -51.8 -30.06 21.66 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 124.558 1.143 . . . . 0.0 113.11 178.912 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 11.9 p-10 -70.67 -13.99 62.29 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 126.842 2.057 . . . . 0.0 114.33 179.437 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 9.9 m-85 -76.52 -14.62 60.01 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 116.384 1.994 . . . . 0.0 116.384 165.697 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 589' ' ' THR . . . . . 0.407 HG22 ' HA ' ' A' ' 527' ' ' ALA . 71.0 p -121.07 173.22 7.41 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 125.617 1.567 . . . . 0.0 111.871 -174.333 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -125.18 140.44 52.86 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 124.175 0.99 . . . . 0.0 110.195 171.417 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 15.4 tpt180 -62.97 114.74 3.86 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 124.682 1.193 . . . . 0.0 110.014 171.122 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 592' ' ' VAL . . . . . 0.44 HG23 ' HB2' ' A' ' 524' ' ' LYS . 2.0 m . . . . . 0 N--CA 1.476 0.861 0 C-N-CA 124.521 1.128 . . . . 0.0 108.87 177.328 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 79.7 Cg_endo . . . . . 0 CA--C 1.542 0.91 0 N-CA-C 113.185 0.417 . . . . 0.0 113.185 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 11.8 t -132.12 128.27 58.87 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.12 0 C-N-CA 124.904 1.281 . . . . 0.0 112.71 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -67.21 136.63 93.85 Favored Pre-proline 0 CA--C 1.549 0.94 0 O-C-N 121.389 -0.82 . . . . 0.0 112.633 -176.896 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -77.41 162.28 30.92 Favored 'Trans proline' 0 CA--C 1.548 1.183 0 C-N-CA 123.032 2.488 . . . . 0.0 113.561 -175.559 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 61.8 Cg_endo . . . . . 0 CA--C 1.54 0.794 0 C-N-CA 123.447 2.765 . . . . 0.0 112.909 -178.709 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 517' ' ' LEU . . . . . 0.48 HD22 HD22 ' A' ' 548' ' ' LEU . 12.1 mt . . . . . 0 CA--C 1.537 0.469 0 N-CA-C 111.213 0.079 . . . . 0.0 111.213 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -64.47 159.48 44.09 Favored 'Trans proline' 0 N--CA 1.458 -0.591 0 C-N-CA 122.986 2.457 . . . . 0.0 112.94 -174.178 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -62.5 135.58 54.06 Favored 'Trans proline' 0 N--CA 1.457 -0.662 0 C-N-CA 122.503 2.135 . . . . 0.0 109.89 177.318 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 77.57 -3.69 58.76 Favored Glycine 0 CA--C 1.531 1.06 0 CA-C-O 117.358 -1.801 . . . . 0.0 115.217 -179.762 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 32.8 t80 -34.64 125.05 0.53 Allowed 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 117.202 2.297 . . . . 0.0 117.202 -176.781 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 45.7 mtm -94.45 -51.43 4.77 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 112.241 0.46 . . . . 0.0 112.241 -178.019 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 523' ' ' PHE . . . . . . . . . . . . . 22.6 p90 -171.0 167.12 7.35 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 127.645 2.378 . . . . 0.0 112.609 -172.072 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 524' ' ' LYS . . . . . 0.473 ' HB2' HG23 ' A' ' 592' ' ' VAL . 72.1 mttt -96.81 160.27 14.46 Favored 'General case' 0 CA--C 1.534 0.332 0 O-C-N 121.234 -0.916 . . . . 0.0 111.027 166.699 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 32.1 m -134.56 158.49 41.77 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 C-N-CA 126.297 1.839 . . . . 0.0 108.614 166.889 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 40.1 tt0 -125.43 130.16 51.29 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-N 119.327 0.967 . . . . 0.0 112.343 173.989 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 527' ' ' ALA . . . . . 0.558 ' HA ' HG22 ' A' ' 589' ' ' THR . . . -64.98 117.9 8.3 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 124.488 1.115 . . . . 0.0 111.426 -177.669 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 75.7 mm-40 -80.87 -29.13 35.8 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 123.474 0.709 . . . . 0.0 111.459 173.497 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 97.8 m-70 -136.83 160.11 39.84 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 125.894 1.678 . . . . 0.0 111.295 -177.928 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . 0.312 4.6 p30 -82.33 136.36 35.03 Favored 'General case' 0 CA--C 1.546 0.807 0 N-CA-C 115.651 1.723 . . . . 0.0 115.651 178.817 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 82.3 t80 -140.26 128.75 22.78 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 126.095 1.758 . . . . 0.0 112.955 -178.551 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 2.6 m -104.17 135.77 45.03 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 124.864 1.266 . . . . 0.0 113.985 175.501 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -73.23 126.77 30.85 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 112.85 0.685 . . . . 0.0 112.85 -173.452 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 2.8 p -90.96 -3.66 57.12 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 127.757 2.423 . . . . 0.0 116.051 177.669 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 24.6 t0 -148.97 159.47 44.17 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.383 1.473 . . . . 0.0 107.878 -170.225 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 2.0 t -67.24 -20.86 65.73 Favored 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 115.048 1.499 . . . . 0.0 115.048 169.448 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 13.8 t0 -82.53 -20.36 36.8 Favored 'General case' 0 CA--C 1.551 0.986 0 C-N-CA 123.349 0.66 . . . . 0.0 110.426 177.562 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 72.1 mt-10 -82.13 153.12 26.2 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 125.252 1.421 . . . . 0.0 114.744 -173.867 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -98.54 139.1 34.78 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 127.684 2.393 . . . . 0.0 110.307 176.668 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 14.3 tt0 -91.38 130.88 37.17 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.001 0.92 . . . . 0.0 111.07 172.233 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 73.4 mt -128.61 139.96 52.01 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 124.939 1.296 . . . . 0.0 112.245 -177.535 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 14.3 tmtt? -110.55 145.7 37.33 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 126.257 1.823 . . . . 0.0 109.872 171.177 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -59.21 94.24 0.02 OUTLIER 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 124.231 1.013 . . . . 0.0 112.5 177.675 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 131.45 -8.81 5.6 Favored Glycine 0 CA--C 1.532 1.099 0 C-N-CA 126.522 2.01 . . . . 0.0 114.758 -173.399 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 86.2 m-20 -70.7 122.22 19.41 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 119.766 1.783 . . . . 0.0 114.248 -178.547 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 3.4 t -72.2 135.96 26.71 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.415 0 CA-C-N 118.378 0.535 . . . . 0.0 110.546 163.281 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 1.3 t -125.1 123.78 66.1 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.453 0 C-N-CA 126.749 2.02 . . . . 0.0 110.607 177.052 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 548' ' ' LEU . . . . . 0.48 HD22 HD22 ' A' ' 517' ' ' LEU . 26.7 mt -81.38 98.69 8.32 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 108.15 -1.056 . . . . 0.0 108.15 177.752 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 549' ' ' VAL . . . . . . . . . . . . . 5.9 t -62.93 132.05 28.62 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.132 0 N-CA-C 114.315 1.228 . . . . 0.0 114.315 175.277 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 15.0 pt -126.63 154.72 75.53 Favored Pre-proline 0 CA--C 1.546 0.807 0 C-N-CA 126.502 1.921 . . . . 0.0 110.395 176.865 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 89.4 Cg_endo -75.69 142.37 25.76 Favored 'Trans proline' 0 C--O 1.241 0.645 0 C-N-CA 123.901 3.067 . . . . 0.0 111.807 177.465 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 48.4 m-85 . . . . . 0 CA--C 1.537 0.478 0 N-CA-C 115.552 1.686 . . . . 0.0 115.552 178.757 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 48.2 tt0 . . . . . 0 C--O 1.236 0.346 0 CA-C-O 121.837 0.827 . . . . 0.0 112.388 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 56.2 m-20 -82.67 141.81 32.18 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 125.262 1.425 . . . . 0.0 109.324 175.991 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 87.4 tt0 -76.94 125.94 30.15 Favored 'General case' 0 N--CA 1.471 0.59 0 O-C-N 120.633 -1.292 . . . . 0.0 110.543 -176.181 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 84.64 7.81 83.84 Favored Glycine 0 CA--C 1.537 1.466 0 CA-C-O 118.869 -0.962 . . . . 0.0 114.978 -171.889 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 43.3 m95 -111.7 155.97 22.62 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 125.709 1.603 . . . . 0.0 114.016 -179.6 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 12.6 mt -123.96 159.3 30.07 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.384 1.073 . . . . 0.0 110.725 172.098 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 51.9 ttm -118.32 143.25 46.75 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 125.051 1.341 . . . . 0.0 111.383 173.004 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -173.56 -167.54 33.43 Favored Glycine 0 CA--C 1.525 0.707 0 C-N-CA 124.256 0.931 . . . . 0.0 112.741 178.277 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 14.7 p -136.03 142.02 40.06 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 C-N-CA 125.378 1.471 . . . . 0.0 109.342 172.738 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 36.4 mtmt -58.1 135.09 56.96 Favored 'General case' 0 N--CA 1.468 0.475 0 O-C-N 121.338 -0.851 . . . . 0.0 110.876 174.989 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -59.41 -39.49 83.61 Favored 'General case' 0 C--O 1.221 -0.43 0 CA-C-O 117.711 -1.138 . . . . 0.0 111.349 177.35 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 7.6 t -68.14 -35.39 78.0 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 120.294 1.406 . . . . 0.0 111.239 179.396 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 83.8 m-20 -65.1 -33.48 76.13 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 115.184 1.55 . . . . 0.0 115.184 171.9 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 58.4 t-105 -83.72 -32.14 25.67 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 125.08 1.352 . . . . 0.0 113.235 175.505 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 18.4 t-20 -75.2 -14.02 60.5 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 127.133 2.173 . . . . 0.0 111.982 172.47 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 8.6 mm-40 -82.45 -4.78 58.02 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 126.676 1.99 . . . . 0.0 113.846 162.705 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 574' ' ' HIS . . . . . . . . . . . . 0.251 69.4 m-70 57.47 27.92 14.7 Favored 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 126.268 1.827 . . . . 0.0 114.735 -179.376 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 22.4 mtpp -72.35 161.82 30.31 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 126.322 1.849 . . . . 0.0 112.893 179.293 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -59.88 105.05 0.34 Allowed 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.184 1.394 . . . . 0.0 113.546 179.109 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 58.6 tp -56.95 -42.58 80.37 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 126.017 1.727 . . . . 0.0 112.283 -174.528 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 15.2 pm0 -55.96 -33.07 64.44 Favored 'General case' 0 CA--C 1.542 0.662 0 N-CA-C 114.545 1.313 . . . . 0.0 114.545 178.257 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 2.0 tppp? -88.98 -43.48 11.1 Favored 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 125.447 1.499 . . . . 0.0 110.786 177.924 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 87.2 m -74.83 -24.54 58.62 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 126.457 1.903 . . . . 0.0 115.146 -173.474 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 46.9 ptt85 -63.56 165.62 7.81 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 125.035 1.334 . . . . 0.0 113.585 177.598 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -172.6 174.9 45.76 Favored Glycine 0 CA--C 1.525 0.701 0 CA-C-N 115.031 -0.986 . . . . 0.0 114.639 165.534 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 32.7 m -91.97 144.51 9.11 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 C-N-CA 124.264 1.026 . . . . 0.0 111.085 166.221 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 38.3 p90 -138.24 154.38 73.85 Favored Pre-proline 0 CA--C 1.539 0.543 0 C-N-CA 125.02 1.328 . . . . 0.0 113.055 177.183 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 65.2 Cg_endo -66.71 108.79 1.51 Allowed 'Trans proline' 0 N--CA 1.457 -0.649 0 C-N-CA 121.786 1.657 . . . . 0.0 109.141 170.259 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -58.83 -21.57 56.92 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 124.01 0.924 . . . . 0.0 113.27 -178.717 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 10.5 p-10 -73.45 -8.19 54.85 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 125.752 1.621 . . . . 0.0 114.16 174.147 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 13.0 m-85 -82.7 -16.5 47.9 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 116.047 1.869 . . . . 0.0 116.047 168.036 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 589' ' ' THR . . . . . 0.558 HG22 ' HA ' ' A' ' 527' ' ' ALA . 17.7 p -122.13 -179.99 4.35 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.449 1.5 . . . . 0.0 108.452 -172.112 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -140.92 142.55 34.41 Favored 'General case' 0 CA--C 1.536 0.429 0 O-C-N 120.721 -1.237 . . . . 0.0 110.23 171.021 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -52.37 135.73 32.58 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 125.407 1.483 . . . . 0.0 110.811 172.968 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 592' ' ' VAL . . . . . 0.473 HG23 ' HB2' ' A' ' 524' ' ' LYS . 1.7 m . . . . . 0 N--CA 1.475 0.816 0 C-N-CA 125.574 1.55 . . . . 0.0 109.412 175.055 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo . . . . . 0 CA--C 1.54 0.792 0 CA-C-O 121.967 0.736 . . . . 0.0 113.865 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 6.8 p -135.05 126.36 46.45 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.706 0 C-N-CA 126.364 1.865 . . . . 0.0 110.387 -177.692 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -65.49 135.9 95.99 Favored Pre-proline 0 CA--C 1.546 0.801 0 O-C-N 121.172 -0.955 . . . . 0.0 111.778 -175.515 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 4.5 Cg_endo -69.07 162.81 40.19 Favored 'Trans proline' 0 CA--C 1.539 0.752 0 C-N-CA 122.292 1.995 . . . . 0.0 112.179 177.896 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo . . . . . 0 CA--C 1.538 0.696 0 C-N-CA 122.537 2.158 . . . . 0.0 111.842 168.345 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 517' ' ' LEU . . . . . 0.415 HD22 HD22 ' A' ' 548' ' ' LEU . 11.0 mt . . . . . 0 CA--C 1.542 0.652 0 CA-C-O 120.555 0.217 . . . . 0.0 111.517 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_endo -68.06 159.36 53.39 Favored 'Trans proline' 0 CA--C 1.54 0.796 0 C-N-CA 123.458 2.772 . . . . 0.0 113.709 -173.768 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -62.92 126.78 18.78 Favored 'Trans proline' 0 C--N 1.347 0.492 0 C-N-CA 123.763 2.976 . . . . 0.0 111.182 -178.44 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 78.72 1.19 83.02 Favored Glycine 0 CA--C 1.533 1.172 0 CA-C-O 117.385 -1.786 . . . . 0.0 115.653 -177.265 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 27.1 t80 -34.84 137.22 0.13 Allowed 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 117.192 2.293 . . . . 0.0 117.192 179.222 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 39.6 mtm -106.29 -61.85 1.46 Allowed 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 123.891 0.876 . . . . 0.0 111.928 -178.073 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 523' ' ' PHE . . . . . . . . . . . . . 23.9 p90 -161.06 170.17 21.02 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 127.28 2.232 . . . . 0.0 112.082 -172.724 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 524' ' ' LYS . . . . . 0.603 ' HB2' HG23 ' A' ' 592' ' ' VAL . 71.9 mttt -104.9 163.83 12.24 Favored 'General case' 0 N--CA 1.467 0.399 0 O-C-N 121.148 -0.97 . . . . 0.0 111.288 170.358 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 8.3 m -132.4 156.53 42.5 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.881 0 C-N-CA 126.299 1.84 . . . . 0.0 109.651 165.894 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 44.2 tt0 -118.38 129.87 55.67 Favored 'General case' 0 N--CA 1.477 0.877 0 CA-C-N 119.795 1.18 . . . . 0.0 111.913 169.394 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 527' ' ' ALA . . . . . 0.513 ' HA ' HG22 ' A' ' 589' ' ' THR . . . -62.11 121.8 13.96 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.155 0.982 . . . . 0.0 111.786 177.766 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 71.7 mm-40 -89.49 -18.15 27.26 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 125.957 1.703 . . . . 0.0 111.978 172.978 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 98.7 m-70 -144.93 161.5 39.2 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 127.577 2.351 . . . . 0.0 109.759 -175.443 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -89.5 133.06 34.74 Favored 'General case' 0 C--O 1.237 0.429 0 N-CA-C 107.079 -1.452 . . . . 0.0 107.079 -179.524 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 88.2 t80 -122.61 106.19 10.76 Favored 'General case' 0 C--O 1.235 0.306 0 C-N-CA 124.772 1.229 . . . . 0.0 113.232 177.59 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -80.6 113.84 19.07 Favored 'General case' 0 N--CA 1.469 0.503 0 N-CA-C 113.251 0.834 . . . . 0.0 113.251 170.071 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -71.47 141.63 50.21 Favored 'General case' 0 C--O 1.238 0.485 0 C-N-CA 125.244 1.418 . . . . 0.0 111.881 179.747 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 5.7 t -110.65 -37.01 5.57 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 126.178 1.791 . . . . 0.0 113.455 177.92 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 84.8 m-20 -95.11 152.48 18.31 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 116.968 2.21 . . . . 0.0 116.968 -177.547 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 4.2 t -57.12 -26.89 61.24 Favored 'General case' 0 N--CA 1.481 1.084 0 N-CA-C 116.138 1.903 . . . . 0.0 116.138 179.812 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 8.2 p30 -92.61 -9.37 41.27 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 116.788 2.144 . . . . 0.0 116.788 174.742 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 86.3 mt-10 -75.69 152.11 37.58 Favored 'General case' 0 CA--C 1.537 0.457 0 O-C-N 120.96 -1.088 . . . . 0.0 113.913 -177.951 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -97.97 132.48 43.5 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 127.561 2.344 . . . . 0.0 109.521 171.577 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 30.0 tt0 -90.03 134.45 34.23 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.037 0.935 . . . . 0.0 111.519 174.912 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 83.1 mt -127.63 155.36 44.0 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 125.007 1.323 . . . . 0.0 112.819 -178.196 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -129.12 142.31 50.92 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 125.556 1.542 . . . . 0.0 109.728 174.029 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -54.8 105.89 0.18 Allowed 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.34 1.056 . . . . 0.0 112.04 -175.616 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 125.43 -15.01 7.24 Favored Glycine 0 CA--C 1.531 1.061 0 C-N-CA 126.684 2.087 . . . . 0.0 113.814 -176.627 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 84.9 m-20 -73.83 119.64 18.33 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 114.909 1.448 . . . . 0.0 114.909 -171.164 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 21.8 t -70.14 137.78 23.34 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 O-C-N 122.057 -0.402 . . . . 0.0 110.83 169.178 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 1.1 t -125.84 127.55 71.36 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 C-N-CA 126.538 1.935 . . . . 0.0 111.399 174.957 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 548' ' ' LEU . . . . . 0.439 ' CD2' ' HE2' ' A' ' 524' ' ' LYS . 20.4 mt -83.76 101.7 11.78 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.356 1.063 . . . . 0.0 108.742 177.495 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 549' ' ' VAL . . . . . . . . . . . . . 6.3 t -63.88 131.12 29.43 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 N-CA-C 113.986 1.106 . . . . 0.0 113.986 174.436 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 24.6 pt -127.11 157.25 72.79 Favored Pre-proline 0 CA--C 1.548 0.87 0 C-N-CA 126.426 1.89 . . . . 0.0 110.276 177.606 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -70.93 156.43 60.3 Favored 'Trans proline' 0 CA--C 1.534 0.519 0 C-N-CA 123.779 2.986 . . . . 0.0 111.54 174.498 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 54.9 m-85 . . . . . 0 CA--C 1.537 0.471 0 N-CA-C 115.72 1.748 . . . . 0.0 115.72 175.998 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 4.1 tp60 . . . . . 0 N--CA 1.476 0.843 0 N-CA-C 113.178 0.807 . . . . 0.0 113.178 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 13.0 m-20 -120.3 156.29 31.56 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 128.173 2.589 . . . . 0.0 116.125 178.66 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -71.31 110.86 6.21 Favored 'General case' 0 N--CA 1.473 0.716 0 O-C-N 120.345 -1.472 . . . . 0.0 114.093 -165.783 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 82.69 7.63 87.13 Favored Glycine 0 CA--C 1.539 1.545 0 O-C-N 121.117 -0.989 . . . . 0.0 114.605 -175.415 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 47.6 m95 -89.64 165.96 13.91 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 126.013 1.725 . . . . 0.0 113.456 176.407 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 18.9 mt -138.48 158.05 45.0 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 126.003 1.721 . . . . 0.0 110.317 170.4 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 47.8 ttm -115.32 142.78 46.23 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 125.058 1.343 . . . . 0.0 112.078 174.011 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -171.8 -174.8 39.61 Favored Glycine 0 CA--C 1.527 0.812 0 C-N-CA 123.771 0.701 . . . . 0.0 113.328 178.056 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 12.1 p -128.11 141.23 47.02 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.829 0 C-N-CA 125.742 1.617 . . . . 0.0 109.15 171.384 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 31.8 mtmt -57.72 136.56 56.89 Favored 'General case' 0 N--CA 1.467 0.411 0 O-C-N 121.328 -0.858 . . . . 0.0 111.563 175.519 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 15.9 tt0 -58.06 -43.58 86.99 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 118.555 -0.736 . . . . 0.0 110.909 176.809 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 38.5 t -65.68 -36.25 83.1 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-N 118.932 0.787 . . . . 0.0 112.583 178.172 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 79.4 m-20 -65.3 -42.53 92.97 Favored 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 114.828 1.418 . . . . 0.0 114.828 173.515 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 72.9 t-105 -69.04 -35.55 76.72 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.564 1.146 . . . . 0.0 112.92 173.914 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 50.9 t-20 -69.06 -31.35 70.05 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 127.429 2.292 . . . . 0.0 111.737 173.891 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 12.5 mm-40 -82.45 0.74 40.84 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.966 1.306 . . . . 0.0 114.149 172.373 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 83.6 m-70 57.26 38.31 28.63 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 126.753 2.021 . . . . 0.0 113.706 178.268 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 22.3 mtpp -86.31 159.05 19.53 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 125.595 1.558 . . . . 0.0 111.043 179.881 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 12.6 pm0 -56.49 98.71 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 115.029 1.492 . . . . 0.0 115.029 -167.179 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 44.6 tp -50.64 -47.18 58.53 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 125.042 1.337 . . . . 0.0 112.665 -173.229 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 72.4 mm-40 -66.27 -12.64 57.62 Favored 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 114.371 1.248 . . . . 0.0 114.371 -174.124 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 13.1 tptp -117.83 -33.16 4.59 Favored 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 125.501 1.521 . . . . 0.0 113.173 177.684 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 71.1 m -65.22 -31.83 73.19 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 125.635 1.574 . . . . 0.0 112.504 173.119 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 29.6 ptt85 -60.1 157.07 13.73 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 123.737 0.815 . . . . 0.0 112.668 172.215 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -171.96 173.91 45.21 Favored Glycine 0 CA--C 1.524 0.62 0 C-N-CA 123.991 0.805 . . . . 0.0 113.205 173.707 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 35.1 m -91.37 141.43 14.47 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.428 0 C-N-CA 124.008 0.923 . . . . 0.0 110.982 169.356 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 50.5 p90 -137.74 154.6 74.89 Favored Pre-proline 0 CA--C 1.538 0.498 0 C-N-CA 123.959 0.903 . . . . 0.0 113.125 175.838 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_endo -70.37 110.07 2.59 Favored 'Trans proline' 0 N--CA 1.458 -0.613 0 C-N-CA 122.207 1.938 . . . . 0.0 110.034 172.11 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 20.8 pt-20 -55.83 -26.53 47.08 Favored 'General case' 0 N--CA 1.474 0.756 0 O-C-N 121.308 -0.87 . . . . 0.0 112.675 -178.805 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 6.6 p-10 -65.35 -15.36 62.48 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 126.131 1.772 . . . . 0.0 114.48 178.199 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 27.5 m-85 -77.48 -10.99 59.79 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 116.582 2.068 . . . . 0.0 116.582 165.537 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 589' ' ' THR . . . . . 0.513 HG22 ' HA ' ' A' ' 527' ' ' ALA . 80.6 p -131.27 169.78 15.5 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 126.131 1.772 . . . . 0.0 111.734 -171.806 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -125.23 142.45 51.49 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 123.987 0.915 . . . . 0.0 110.228 172.23 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.55 134.5 56.18 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 125.252 1.421 . . . . 0.0 110.999 172.009 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 592' ' ' VAL . . . . . 0.603 HG23 ' HB2' ' A' ' 524' ' ' LYS . 5.4 m . . . . . 0 CA--C 1.553 1.06 0 C-N-CA 124.785 1.234 . . . . 0.0 111.584 -178.546 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 49.8 Cg_endo . . . . . 0 CA--C 1.547 1.125 0 N-CA-C 115.25 1.212 . . . . 0.0 115.25 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 60.3 t -132.65 129.87 58.93 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.068 0 C-N-CA 125.9 1.68 . . . . 0.0 110.73 178.572 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -65.08 131.41 95.15 Favored Pre-proline 0 CA--C 1.556 1.185 0 O-C-N 121.481 -0.762 . . . . 0.0 112.924 -177.348 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 50.4 Cg_endo -74.06 157.3 46.83 Favored 'Trans proline' 0 CA--C 1.541 0.842 0 C-N-CA 123.105 2.537 . . . . 0.0 114.111 -170.15 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo . . . . . 0 CA--C 1.535 0.56 0 C-N-CA 123.808 3.005 . . . . 0.0 112.802 -172.291 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 517' ' ' LEU . . . . . 0.408 HD22 HD22 ' A' ' 548' ' ' LEU . 10.6 mt . . . . . 0 CA--C 1.552 1.042 0 N-CA-C 114.61 1.337 . . . . 0.0 114.61 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -71.0 161.14 47.12 Favored 'Trans proline' 0 CA--C 1.541 0.867 0 C-N-CA 124.655 3.57 . . . . 0.0 113.981 -172.205 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -68.19 123.95 11.19 Favored 'Trans proline' 0 C--O 1.239 0.542 0 C-N-CA 123.481 2.787 . . . . 0.0 111.818 -173.488 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 82.15 1.53 90.37 Favored Glycine 0 CA--C 1.537 1.415 0 CA-C-O 117.757 -1.579 . . . . 0.0 115.808 -175.454 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 30.6 t80 -34.18 132.02 0.28 Allowed 'General case' 0 CA--C 1.546 0.808 0 N-CA-C 118.435 2.754 . . . . 0.0 118.435 -178.53 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 31.7 mtm -101.59 -53.93 2.87 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 113.479 0.918 . . . . 0.0 113.479 -176.732 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 523' ' ' PHE . . . . . 0.46 ' CE1' HG21 ' A' ' 549' ' ' VAL . 19.3 p90 -170.02 171.09 7.21 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 126.508 1.923 . . . . 0.0 111.893 -173.299 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 524' ' ' LYS . . . . . 0.516 ' HE2' ' CD2' ' A' ' 548' ' ' LEU . 76.5 mttt -104.61 163.21 12.64 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-O 122.228 1.013 . . . . 0.0 111.684 167.904 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 12.3 m -134.34 162.44 39.01 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 126.552 1.941 . . . . 0.0 109.55 165.317 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 52.5 tt0 -127.28 129.8 48.38 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 119.035 0.834 . . . . 0.0 112.137 171.136 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 527' ' ' ALA . . . . . 0.569 ' HA ' HG22 ' A' ' 589' ' ' THR . . . -62.84 129.62 41.27 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.119 0.967 . . . . 0.0 111.302 -178.644 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 62.6 mm-40 -98.08 -12.8 21.46 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 124.915 1.286 . . . . 0.0 112.708 173.461 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 89.0 m-70 -146.74 160.14 42.6 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 128.064 2.545 . . . . 0.0 109.243 -179.87 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 21.4 p-10 -78.53 146.14 34.47 Favored 'General case' 0 N--CA 1.466 0.375 0 O-C-N 121.432 -0.792 . . . . 0.0 111.853 170.061 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 79.3 t80 -139.72 118.27 12.24 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 124.999 1.32 . . . . 0.0 110.846 175.71 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 2.2 m -91.57 132.14 36.51 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 124.909 1.284 . . . . 0.0 113.883 173.546 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -71.19 120.83 17.33 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 123.584 0.754 . . . . 0.0 112.321 -171.208 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 2.4 p -89.23 -5.53 57.58 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 126.216 1.807 . . . . 0.0 115.763 177.595 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 8.6 t0 -147.21 158.79 44.08 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.266 1.026 . . . . 0.0 108.905 178.971 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 6.3 t -59.79 -23.08 62.99 Favored 'General case' 0 N--CA 1.477 0.914 0 N-CA-C 115.061 1.504 . . . . 0.0 115.061 169.567 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 23.3 t0 -75.62 -33.75 60.54 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 124.512 1.125 . . . . 0.0 110.686 174.771 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 83.6 mt-10 -73.57 147.22 44.11 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.011 1.325 . . . . 0.0 113.345 -171.071 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -92.52 138.16 31.75 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 127.275 2.23 . . . . 0.0 109.825 175.123 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 14.0 tt0 -94.07 119.54 33.07 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 123.956 0.902 . . . . 0.0 111.316 175.492 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 59.5 mt -111.59 142.17 44.23 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 124.447 1.099 . . . . 0.0 111.76 179.272 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 16.0 tptp -106.18 142.19 36.29 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 124.737 1.215 . . . . 0.0 109.816 162.498 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -47.49 121.55 4.03 Favored 'General case' 0 CA--C 1.544 0.726 0 CA-C-O 121.657 0.742 . . . . 0.0 110.881 173.66 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 98.05 -3.81 60.51 Favored Glycine 0 CA--C 1.53 0.998 0 C-N-CA 125.191 1.377 . . . . 0.0 114.127 -178.715 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 82.0 m-20 -67.5 122.11 17.27 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 118.798 1.299 . . . . 0.0 114.228 174.854 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 2.3 t -74.89 135.19 27.84 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 CA-C-N 118.554 0.615 . . . . 0.0 111.552 165.889 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -125.31 121.5 60.69 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 C-N-CA 125.443 1.497 . . . . 0.0 111.744 177.494 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 548' ' ' LEU . . . . . 0.516 ' CD2' ' HE2' ' A' ' 524' ' ' LYS . 17.8 mt -77.13 99.28 5.33 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.609 1.164 . . . . 0.0 108.595 175.241 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 549' ' ' VAL . . . . . 0.46 HG21 ' CE1' ' A' ' 523' ' ' PHE . 2.8 t -60.58 128.48 21.79 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.955 0 N-CA-C 114.011 1.115 . . . . 0.0 114.011 171.142 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 8.7 pt -123.82 154.06 67.22 Favored Pre-proline 0 CA--C 1.547 0.852 0 C-N-CA 126.438 1.895 . . . . 0.0 109.749 177.485 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -70.6 148.9 60.66 Favored 'Trans proline' 0 N--CA 1.461 -0.429 0 C-N-CA 123.653 2.902 . . . . 0.0 110.129 173.862 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 46.7 m-85 . . . . . 0 CA--C 1.535 0.388 0 N-CA-C 114.386 1.254 . . . . 0.0 114.386 176.075 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 50.6 tt0 . . . . . 0 C--O 1.234 0.25 0 CA-C-O 121.962 0.887 . . . . 0.0 112.722 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 68.9 m-20 -94.24 151.82 19.16 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 125.328 1.451 . . . . 0.0 114.109 177.775 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 80.7 tt0 -82.28 119.16 23.75 Favored 'General case' 0 CA--C 1.541 0.597 0 O-C-N 121.053 -1.029 . . . . 0.0 111.907 -167.866 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 81.94 1.58 90.31 Favored Glycine 0 CA--C 1.543 1.797 0 C-N-CA 124.327 0.965 . . . . 0.0 114.834 -171.352 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 47.5 m95 -94.38 167.01 11.79 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 126.78 2.032 . . . . 0.0 113.253 176.45 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 22.7 mt -139.56 159.7 41.55 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 125.192 1.397 . . . . 0.0 110.887 169.933 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 46.0 ttm -115.17 143.84 44.6 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 125.501 1.52 . . . . 0.0 112.712 176.238 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -167.34 -173.44 35.53 Favored Glycine 0 CA--C 1.525 0.705 0 C-N-CA 124.057 0.837 . . . . 0.0 113.374 175.063 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 14.3 p -129.84 142.03 44.9 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 C-N-CA 125.836 1.655 . . . . 0.0 109.477 170.989 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 34.0 mtmt -59.04 132.61 54.56 Favored 'General case' 0 N--CA 1.467 0.421 0 O-C-N 121.428 -0.795 . . . . 0.0 111.929 176.189 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 18.3 tt0 -59.42 -42.61 92.23 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 118.473 -0.775 . . . . 0.0 111.124 178.758 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 34.0 t -65.31 -30.79 71.68 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 119.254 0.934 . . . . 0.0 111.963 178.699 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -70.6 -40.77 73.02 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 115.086 1.513 . . . . 0.0 115.086 173.1 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 64.3 t-105 -71.06 -30.42 66.56 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.217 1.407 . . . . 0.0 112.992 172.116 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 10.1 t-20 -67.52 -34.03 76.28 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 126.472 1.909 . . . . 0.0 111.585 172.161 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 35.4 mt-30 -80.77 -0.07 36.98 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 124.886 1.275 . . . . 0.0 113.44 168.0 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 9.0 m-70 53.78 37.43 26.31 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 126.061 1.744 . . . . 0.0 112.943 179.444 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 6.0 mtpm? -73.17 156.46 38.59 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 125.05 1.34 . . . . 0.0 110.854 175.882 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 12.1 pm0 -57.35 105.79 0.27 Allowed 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 125.038 1.335 . . . . 0.0 114.159 -167.919 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 55.2 tp -55.25 -48.15 74.39 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 124.505 1.122 . . . . 0.0 112.814 -170.139 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 1.2 pp20? -66.29 -16.45 64.05 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 125.253 1.421 . . . . 0.0 114.651 -175.401 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 32.3 mmtm -106.74 -37.51 6.38 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.681 1.193 . . . . 0.0 112.671 173.213 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 91.2 m -68.47 -28.57 67.15 Favored 'General case' 0 CA--C 1.537 0.479 0 N-CA-C 112.93 0.715 . . . . 0.0 112.93 -179.816 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 38.4 ptt85 -64.29 156.99 27.24 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 113.223 0.823 . . . . 0.0 113.223 176.757 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -169.85 171.04 43.18 Favored Glycine 0 N--CA 1.466 0.697 0 CA-C-N 115.765 -0.652 . . . . 0.0 114.52 176.354 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 17.4 m -90.44 137.16 22.17 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 C-N-CA 124.753 1.221 . . . . 0.0 112.236 172.403 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 48.0 p90 -135.15 155.29 79.07 Favored Pre-proline 0 C--O 1.241 0.629 0 C-N-CA 124.502 1.121 . . . . 0.0 112.932 176.832 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_endo -69.83 109.2 2.27 Favored 'Trans proline' 0 N--CA 1.455 -0.785 0 C-N-CA 121.773 1.649 . . . . 0.0 109.359 169.84 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 20.3 pt-20 -54.41 -23.5 16.08 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 124.16 0.984 . . . . 0.0 113.578 -179.805 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 9.7 p-10 -77.84 -11.29 59.87 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 127.151 2.181 . . . . 0.0 114.755 177.858 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 11.6 m-85 -75.67 -15.76 60.28 Favored 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 116.733 2.123 . . . . 0.0 116.733 162.294 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 589' ' ' THR . . . . . 0.569 HG22 ' HA ' ' A' ' 527' ' ' ALA . 40.8 p -120.16 174.34 6.56 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 125.495 1.518 . . . . 0.0 109.479 -174.596 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -122.34 139.33 53.95 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 123.871 0.869 . . . . 0.0 109.313 172.192 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.03 116.09 8.28 Favored 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 108.088 -1.079 . . . . 0.0 108.088 176.667 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 592' ' ' VAL . . . . . 0.477 HG23 ' HB2' ' A' ' 524' ' ' LYS . 4.6 m . . . . . 0 N--CA 1.474 0.757 0 C-N-CA 124.623 1.169 . . . . 0.0 108.062 175.743 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo . . . . . 0 CA--C 1.536 0.615 0 CA-C-O 121.134 0.389 . . . . 0.0 112.397 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 5.9 t -125.57 129.64 72.75 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.858 0 C-N-CA 124.777 1.231 . . . . 0.0 112.41 -176.624 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -69.34 141.52 91.24 Favored Pre-proline 0 CA--C 1.548 0.896 0 O-C-N 121.818 -0.551 . . . . 0.0 112.163 -177.112 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 3.6 Cg_endo -66.1 162.32 36.12 Favored 'Trans proline' 0 CA--C 1.541 0.864 0 C-N-CA 122.541 2.161 . . . . 0.0 112.596 172.912 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo . . . . . 0 CA--C 1.54 0.788 0 C-N-CA 123.195 2.597 . . . . 0.0 112.809 163.435 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 517' ' ' LEU . . . . . 0.454 HD22 HD22 ' A' ' 548' ' ' LEU . 13.8 mt . . . . . 0 CA--C 1.546 0.797 0 N-CA-C 111.88 0.326 . . . . 0.0 111.88 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_endo -66.97 159.55 51.39 Favored 'Trans proline' 0 CA--C 1.544 0.99 0 C-N-CA 124.242 3.295 . . . . 0.0 113.932 -172.725 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_endo -61.13 121.72 10.08 Favored 'Trans proline' 0 CA--C 1.536 0.594 0 C-N-CA 123.707 2.938 . . . . 0.0 112.121 -173.298 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 77.54 4.22 84.31 Favored Glycine 0 CA--C 1.536 1.348 0 CA-C-O 117.081 -1.955 . . . . 0.0 116.27 -178.674 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 15.4 t80 -28.17 130.94 0.05 Allowed 'General case' 0 CA--C 1.547 0.851 0 N-CA-C 118.434 2.753 . . . . 0.0 118.434 178.008 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 48.5 mtm -99.41 -53.85 3.11 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 113.283 0.845 . . . . 0.0 113.283 -177.178 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 523' ' ' PHE . . . . . . . . . . . . . 17.8 p90 -166.52 165.96 16.54 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 126.439 1.896 . . . . 0.0 112.942 -172.683 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 524' ' ' LYS . . . . . 0.538 ' HE2' ' CD2' ' A' ' 548' ' ' LEU . 74.0 mttt -98.39 162.48 13.14 Favored 'General case' 0 CA--C 1.539 0.522 0 O-C-N 121.194 -0.942 . . . . 0.0 111.545 165.813 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 19.8 m -135.6 159.54 40.01 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 C-N-CA 126.546 1.938 . . . . 0.0 109.259 167.12 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 30.5 tt0 -122.04 126.86 49.43 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 124.052 0.941 . . . . 0.0 111.441 174.633 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 527' ' ' ALA . . . . . 0.485 ' HA ' HG22 ' A' ' 589' ' ' THR . . . -61.51 124.28 20.2 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 123.975 0.91 . . . . 0.0 111.629 179.253 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 38.8 mm-40 -87.38 -18.98 28.8 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 125.825 1.65 . . . . 0.0 112.232 176.751 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 97.0 m-70 -148.37 169.12 20.87 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 128.468 2.707 . . . . 0.0 109.84 -177.507 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -83.16 144.55 29.75 Favored 'General case' 0 CA--C 1.539 0.528 0 O-C-N 121.117 -0.989 . . . . 0.0 108.937 172.996 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 84.3 t80 -134.63 117.25 15.9 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 124.679 1.192 . . . . 0.0 113.234 173.489 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -86.95 116.08 24.77 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 114.335 1.235 . . . . 0.0 114.335 174.486 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -66.25 137.79 57.21 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 123.376 0.67 . . . . 0.0 112.013 177.615 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 13.4 t -112.43 -26.91 8.48 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 125.573 1.549 . . . . 0.0 114.012 175.807 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 27.4 t0 -93.64 149.98 20.79 Favored 'General case' 0 N--CA 1.473 0.721 0 O-C-N 120.857 -1.152 . . . . 0.0 108.323 175.069 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 536' ' ' THR . . . . . . . . . . . . 0.255 0.6 OUTLIER -59.2 -19.56 46.42 Favored 'General case' 0 N--CA 1.469 0.488 0 N-CA-C 115.998 1.851 . . . . 0.0 115.998 165.188 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 38.8 m-20 -82.19 -15.62 52.57 Favored 'General case' 0 CA--C 1.542 0.663 0 N-CA-C 117.625 2.454 . . . . 0.0 117.625 168.995 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 61.0 mt-10 -86.06 145.43 27.07 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 114.541 1.311 . . . . 0.0 114.541 -172.713 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -87.93 136.1 33.11 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 126.476 1.91 . . . . 0.0 110.415 174.369 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 38.9 tt0 -94.53 129.81 41.18 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 125.176 1.39 . . . . 0.0 110.83 177.478 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 81.4 mt -124.85 154.02 41.68 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 125.112 1.365 . . . . 0.0 112.146 -178.316 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 6.3 tmtm? -126.48 144.27 50.91 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 125.873 1.669 . . . . 0.0 108.223 168.739 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -47.84 117.74 2.0 Favored 'General case' 0 CA--C 1.543 0.709 0 CA-C-O 122.422 1.105 . . . . 0.0 112.267 177.598 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 103.96 -5.14 46.11 Favored Glycine 0 CA--C 1.529 0.968 0 C-N-CA 127.179 2.323 . . . . 0.0 113.577 178.287 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 75.4 m-20 -73.71 127.68 33.45 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 118.945 1.372 . . . . 0.0 114.436 -173.603 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 2.0 t -76.98 135.18 27.15 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 N-CA-C 112.473 0.546 . . . . 0.0 112.473 173.897 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 1.2 t -126.48 122.88 62.08 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 C-N-CA 125.199 1.4 . . . . 0.0 111.81 177.272 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 548' ' ' LEU . . . . . 0.538 ' CD2' ' HE2' ' A' ' 524' ' ' LYS . 17.5 mt -78.03 99.61 6.17 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 124.488 1.115 . . . . 0.0 108.636 174.56 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 549' ' ' VAL . . . . . . . . . . . . . 4.6 t -62.5 128.61 24.57 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.032 0 N-CA-C 113.666 0.987 . . . . 0.0 113.666 171.497 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 10.9 pt -119.45 153.68 53.94 Favored Pre-proline 0 N--CA 1.47 0.552 0 C-N-CA 126.138 1.775 . . . . 0.0 109.817 179.877 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 77.4 Cg_endo -67.11 142.73 62.48 Favored 'Trans proline' 0 N--CA 1.458 -0.596 0 C-N-CA 122.823 2.349 . . . . 0.0 110.443 175.981 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 552' ' ' PHE . . . . . 0.427 ' CE1' ' HA ' ' A' ' 558' ' ' GLN . 39.1 m-85 . . . . . 0 CA--C 1.53 0.179 0 N-CA-C 117.288 2.329 . . . . 0.0 117.288 -177.087 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 558' ' ' GLN . . . . . 0.427 ' HA ' ' CE1' ' A' ' 552' ' ' PHE . 7.0 tt0 . . . . . 0 N--CA 1.465 0.317 0 CA-C-O 122.035 0.921 . . . . 0.0 112.683 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . 0.296 9.1 m-20 -96.67 138.92 33.51 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 116.744 2.128 . . . . 0.0 116.744 172.775 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 17.3 tp10 -68.05 124.62 23.92 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.695 1.198 . . . . 0.0 111.007 -177.73 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 83.51 -2.99 86.42 Favored Glycine 0 CA--C 1.535 1.341 0 C-N-CA 125.134 1.349 . . . . 0.0 115.173 -171.409 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 50.2 m95 -98.93 161.3 13.7 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 125.312 1.445 . . . . 0.0 112.348 172.891 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 13.1 mt -137.31 154.94 49.98 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 124.688 1.195 . . . . 0.0 110.213 172.263 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 56.5 ttm -116.23 141.14 48.53 Favored 'General case' 0 N--CA 1.464 0.229 0 C-N-CA 124.717 1.207 . . . . 0.0 111.537 178.172 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -173.1 -171.87 38.16 Favored Glycine 0 CA--C 1.522 0.5 0 C-N-CA 123.341 0.496 . . . . 0.0 113.028 -179.836 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 13.2 p -133.17 140.97 45.9 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.634 0 C-N-CA 125.76 1.624 . . . . 0.0 108.916 171.943 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 35.4 mtmt -58.48 137.85 57.08 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 121.284 -0.885 . . . . 0.0 111.16 176.35 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -60.36 -41.76 94.39 Favored 'General case' 0 C--O 1.22 -0.45 0 CA-C-O 118.9 -0.571 . . . . 0.0 110.707 174.661 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 32.1 t -67.91 -20.18 65.07 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 119.151 0.887 . . . . 0.0 113.062 177.24 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 33.8 m-20 -78.57 -44.92 22.99 Favored 'General case' 0 CA--C 1.541 0.63 0 O-C-N 120.642 -1.287 . . . . 0.0 114.351 168.554 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 66.0 t-105 -72.63 -33.84 66.91 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 125.907 1.683 . . . . 0.0 113.618 177.898 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 44.3 t-20 -71.79 -21.64 61.69 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 127.063 2.145 . . . . 0.0 111.848 172.628 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 75.4 mt-30 -91.2 1.19 57.28 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.972 1.309 . . . . 0.0 113.544 164.97 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 93.4 m-70 59.68 28.75 18.24 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 126.782 2.033 . . . . 0.0 114.854 170.484 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 75.0 mttt -68.34 163.28 23.42 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 126.144 1.778 . . . . 0.0 111.855 179.245 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 4.8 pm0 -54.72 111.44 0.81 Allowed 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 113.653 0.983 . . . . 0.0 113.653 -175.143 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 50.5 tp -64.0 -34.71 78.63 Favored 'General case' 0 N--CA 1.469 0.504 0 O-C-N 120.659 -1.276 . . . . 0.0 111.223 -169.444 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 32.5 mp0 -72.86 -17.55 61.52 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 125.545 1.538 . . . . 0.0 113.737 -174.415 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 50.1 mmtt -118.91 -25.09 6.37 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 125.334 1.454 . . . . 0.0 114.256 179.223 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 98.0 m -71.32 -33.0 69.27 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 118.526 0.603 . . . . 0.0 112.128 169.211 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 15.1 ptp180 -63.25 165.14 7.77 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-O 121.888 0.851 . . . . 0.0 112.886 173.761 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -178.12 178.63 48.56 Favored Glycine 0 CA--C 1.523 0.531 0 CA-C-N 115.034 -0.985 . . . . 0.0 112.593 171.799 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 27.5 m -93.66 141.48 14.73 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.461 0 C-N-CA 123.758 0.823 . . . . 0.0 110.697 167.293 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 43.8 p90 -134.04 154.48 80.24 Favored Pre-proline 0 C--O 1.24 0.563 0 C-N-CA 124.997 1.319 . . . . 0.0 112.371 175.415 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -68.44 112.48 2.83 Favored 'Trans proline' 0 N--CA 1.459 -0.53 0 C-N-CA 121.86 1.707 . . . . 0.0 109.214 172.398 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 19.5 pt-20 -56.87 -26.98 59.82 Favored 'General case' 0 N--CA 1.476 0.844 0 O-C-N 121.252 -0.905 . . . . 0.0 112.428 -176.979 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 6.7 p-10 -64.81 -23.73 67.33 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 125.782 1.633 . . . . 0.0 113.594 177.023 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 23.0 m-85 -69.86 -11.63 61.01 Favored 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 117.074 2.25 . . . . 0.0 117.074 166.577 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 589' ' ' THR . . . . . 0.485 HG22 ' HA ' ' A' ' 527' ' ' ALA . 71.5 p -128.53 174.59 9.24 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 125.603 1.561 . . . . 0.0 110.546 -176.391 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -134.37 145.81 49.32 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 123.612 0.765 . . . . 0.0 110.711 169.596 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -58.83 135.14 57.42 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 124.959 1.303 . . . . 0.0 110.804 175.542 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 592' ' ' VAL . . . . . 0.484 HG23 ' HB2' ' A' ' 524' ' ' LYS . 3.1 m . . . . . 0 CA--C 1.544 0.745 0 C-N-CA 126.013 1.725 . . . . 0.0 107.762 173.851 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo . . . . . 0 CA--C 1.54 0.798 0 CA-C-O 122.219 0.841 . . . . 0.0 113.511 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 7.1 t -134.26 129.54 53.49 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 C-N-CA 125.796 1.638 . . . . 0.0 112.123 -176.53 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -69.55 133.79 88.78 Favored Pre-proline 0 CA--C 1.555 1.161 0 O-C-N 121.558 -0.714 . . . . 0.0 112.596 -177.04 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -80.05 164.06 22.55 Favored 'Trans proline' 0 CA--C 1.547 1.161 0 C-N-CA 123.274 2.649 . . . . 0.0 113.353 -177.888 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 77.1 Cg_exo . . . . . 0 CA--C 1.54 0.79 0 C-N-CA 123.716 2.944 . . . . 0.0 114.907 -178.764 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 517' ' ' LEU . . . . . 0.448 HD22 HD22 ' A' ' 548' ' ' LEU . 10.3 mt . . . . . 0 CA--C 1.55 0.972 0 N-CA-C 111.966 0.358 . . . . 0.0 111.966 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -73.15 160.51 45.24 Favored 'Trans proline' 0 CA--C 1.539 0.757 0 C-N-CA 123.677 2.918 . . . . 0.0 113.394 -174.983 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -62.81 135.0 49.66 Favored 'Trans proline' 0 N--CA 1.459 -0.547 0 C-N-CA 123.353 2.702 . . . . 0.0 110.228 178.867 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 76.82 -1.34 62.93 Favored Glycine 0 CA--C 1.534 1.254 0 CA-C-O 117.295 -1.836 . . . . 0.0 115.508 -178.139 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 49.0 t80 -41.29 131.69 2.73 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 120.683 2.241 . . . . 0.0 115.741 -177.317 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 65.6 mtm -105.52 -56.27 2.2 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 123.269 0.628 . . . . 0.0 111.595 179.547 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 523' ' ' PHE . . . . . . . . . . . . . 21.9 p90 -161.33 168.24 24.31 Favored 'General case' 0 C--O 1.224 -0.239 0 C-N-CA 125.88 1.672 . . . . 0.0 113.35 -173.417 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 524' ' ' LYS . . . . . 0.545 ' HE2' ' CD2' ' A' ' 548' ' ' LEU . 41.9 mttt -98.44 163.58 12.63 Favored 'General case' 0 N--CA 1.469 0.506 0 O-C-N 121.223 -0.923 . . . . 0.0 112.155 165.371 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 13.7 m -133.91 158.48 42.41 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 C-N-CA 126.706 2.002 . . . . 0.0 109.171 164.228 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 54.8 tt0 -122.0 131.57 54.07 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 119.12 0.873 . . . . 0.0 112.034 170.701 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 527' ' ' ALA . . . . . 0.449 ' HA ' HG22 ' A' ' 589' ' ' THR . . . -64.15 125.38 24.34 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 121.115 -0.991 . . . . 0.0 112.68 179.166 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 58.8 mm-40 -89.54 -23.94 21.88 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 125.791 1.636 . . . . 0.0 112.024 174.04 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 96.6 m-70 -141.28 162.53 35.27 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 126.768 2.027 . . . . 0.0 110.699 -175.323 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -80.67 128.1 33.24 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 125.68 1.592 . . . . 0.0 113.825 176.782 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 86.2 t80 -129.27 115.67 17.97 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.521 1.129 . . . . 0.0 113.933 179.18 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -79.36 121.84 25.63 Favored 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 116.139 1.904 . . . . 0.0 116.139 175.365 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -71.33 124.49 24.67 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 118.723 0.692 . . . . 0.0 111.455 175.533 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 9.8 t -129.41 37.93 3.94 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 127.095 2.158 . . . . 0.0 110.089 -177.399 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 18.6 t0 -161.78 158.2 25.35 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.804 1.642 . . . . 0.0 107.67 166.211 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 3.1 t -62.73 -21.32 65.71 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 114.982 1.475 . . . . 0.0 114.982 164.539 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 29.0 t0 -74.95 -30.07 61.12 Favored 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 125.343 1.457 . . . . 0.0 110.364 173.969 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 67.7 mt-10 -84.64 154.74 22.35 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 115.515 1.672 . . . . 0.0 115.515 -164.872 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -102.88 134.04 46.96 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 127.449 2.3 . . . . 0.0 110.217 174.118 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 29.5 tt0 -87.63 128.72 35.27 Favored 'General case' 0 CA--C 1.537 0.457 0 O-C-N 121.483 -0.761 . . . . 0.0 110.965 174.661 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 78.2 mt -120.82 146.76 46.2 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 123.971 0.908 . . . . 0.0 111.088 178.53 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 7.3 tmtm? -121.86 144.94 48.54 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 125.447 1.499 . . . . 0.0 108.693 170.47 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -55.24 109.81 0.59 Allowed 'General case' 0 CA--C 1.548 0.871 0 CA-C-O 121.601 0.715 . . . . 0.0 111.622 -177.74 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 118.1 -11.13 13.24 Favored Glycine 0 CA--C 1.534 1.242 0 C-N-CA 126.857 2.17 . . . . 0.0 114.652 -175.539 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 85.9 m-20 -70.38 120.17 15.64 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 119.604 1.702 . . . . 0.0 114.017 -173.795 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 1.8 t -72.39 135.6 27.45 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.088 0 CA-C-N 119.051 0.841 . . . . 0.0 112.547 167.22 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 1.1 t -126.93 122.49 60.49 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.455 0 C-N-CA 126.236 1.814 . . . . 0.0 111.708 177.635 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 548' ' ' LEU . . . . . 0.545 ' CD2' ' HE2' ' A' ' 524' ' ' LYS . 19.1 mt -77.92 101.45 6.84 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 124.845 1.258 . . . . 0.0 108.787 174.548 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 549' ' ' VAL . . . . . . . . . . . . . 5.0 t -63.6 131.42 29.16 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.076 0 N-CA-C 114.252 1.204 . . . . 0.0 114.252 173.497 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 3.8 pt -130.51 154.53 81.65 Favored Pre-proline 0 CA--C 1.547 0.854 0 C-N-CA 127.027 2.131 . . . . 0.0 109.318 177.3 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo -71.9 143.85 41.92 Favored 'Trans proline' 0 CA--C 1.536 0.62 0 C-N-CA 123.442 2.762 . . . . 0.0 110.989 174.983 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 19.3 m-85 . . . . . 0 N--CA 1.466 0.344 0 N-CA-C 117.739 2.496 . . . . 0.0 117.739 -170.604 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 38.3 tt0 . . . . . 0 CA--C 1.536 0.427 0 N-CA-C 112.685 0.624 . . . . 0.0 112.685 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -101.06 144.92 29.4 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 124.673 1.189 . . . . 0.0 108.496 -173.583 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 43.0 tp10 -73.64 124.36 25.8 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.407 1.083 . . . . 0.0 111.787 -174.694 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 82.01 2.07 90.47 Favored Glycine 0 CA--C 1.54 1.646 0 C-N-CA 124.374 0.987 . . . . 0.0 115.273 -175.844 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 45.2 m95 -97.9 165.98 11.67 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 126.132 1.773 . . . . 0.0 113.427 176.3 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 14.7 mt -133.46 161.28 34.98 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 124.702 1.201 . . . . 0.0 110.654 168.239 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 50.6 ttm -119.29 144.51 46.76 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 125.362 1.465 . . . . 0.0 111.52 176.21 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -173.68 -173.43 39.88 Favored Glycine 0 CA--C 1.527 0.801 0 C-N-CA 124.275 0.941 . . . . 0.0 113.399 177.384 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 13.9 p -130.92 141.73 45.42 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 C-N-CA 126.265 1.826 . . . . 0.0 108.907 172.76 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 26.7 mtmt -61.35 139.44 58.18 Favored 'General case' 0 N--CA 1.468 0.459 0 O-C-N 120.867 -1.146 . . . . 0.0 111.771 177.9 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 20.8 tt0 -61.77 -42.31 98.82 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-O 118.288 -0.863 . . . . 0.0 111.17 178.639 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 24.6 t -65.43 -30.55 71.36 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-N 119.36 0.982 . . . . 0.0 112.61 177.041 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 89.0 m-20 -67.28 -43.58 81.41 Favored 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 114.555 1.317 . . . . 0.0 114.555 171.691 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 64.3 t-105 -71.91 -26.69 62.41 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.885 1.274 . . . . 0.0 113.285 172.694 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 7.3 t-20 -74.47 -31.15 62.13 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.862 1.665 . . . . 0.0 111.093 171.792 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 64.5 mm-40 -77.41 -7.08 55.57 Favored 'General case' 0 N--CA 1.477 0.894 0 CA-C-N 119.09 0.859 . . . . 0.0 113.23 166.799 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 12.1 m-70 63.24 32.09 15.1 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 127.284 2.234 . . . . 0.0 112.728 178.335 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 28.6 mttm -63.27 157.29 23.15 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 125.073 1.349 . . . . 0.0 112.649 179.53 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 3.9 pm0 -52.81 101.19 0.04 OUTLIER 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 124.865 1.266 . . . . 0.0 113.055 -179.448 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 26.4 tp -59.08 -47.95 83.39 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 124.165 0.986 . . . . 0.0 111.351 -163.428 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 21.0 mp0 -73.17 -18.55 61.25 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 115.461 -0.791 . . . . 0.0 112.098 -168.377 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 57.3 tptt -95.56 -36.02 11.43 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 124.69 1.196 . . . . 0.0 112.92 170.022 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 6.3 t -77.9 -22.27 49.95 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 124.112 0.965 . . . . 0.0 112.901 -174.164 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 32.0 ptt180 -64.26 163.11 13.42 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.802 1.241 . . . . 0.0 112.327 171.94 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -170.56 173.65 44.43 Favored Glycine 0 CA--C 1.526 0.769 0 C-N-CA 123.874 0.749 . . . . 0.0 113.95 175.654 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 19.5 m -91.55 144.16 9.78 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 C-N-CA 124.641 1.176 . . . . 0.0 112.064 170.704 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 47.5 p90 -140.9 153.74 67.8 Favored Pre-proline 0 CA--C 1.543 0.684 0 C-N-CA 124.782 1.233 . . . . 0.0 113.202 177.094 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -65.79 112.16 2.13 Favored 'Trans proline' 0 C--N 1.347 0.484 0 C-N-CA 122.195 1.93 . . . . 0.0 109.543 169.906 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 21.9 pt-20 -54.37 -31.14 54.0 Favored 'General case' 0 N--CA 1.473 0.721 0 O-C-N 121.735 -0.603 . . . . 0.0 112.243 -178.388 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 9.7 p-10 -68.46 -17.36 64.17 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 126.642 1.977 . . . . 0.0 114.318 -179.86 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 19.4 m-85 -72.13 -11.08 60.58 Favored 'General case' 0 CA--C 1.534 0.365 0 N-CA-C 116.269 1.951 . . . . 0.0 116.269 164.369 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 589' ' ' THR . . . . . 0.449 HG22 ' HA ' ' A' ' 527' ' ' ALA . 71.5 p -129.85 166.42 20.0 Favored 'General case' 0 C--O 1.234 0.237 0 C-N-CA 125.809 1.644 . . . . 0.0 112.037 -173.999 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -122.93 134.34 54.36 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 123.547 0.739 . . . . 0.0 110.377 176.941 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.84 123.93 21.92 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 125.808 1.643 . . . . 0.0 109.555 -177.548 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 592' ' ' VAL . . . . . . . . . . . . . 6.9 m . . . . . 0 CA--C 1.552 1.034 0 C-N-CA 124.854 1.262 . . . . 0.0 109.306 -177.211 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 70.5 Cg_endo . . . . . 0 CA--C 1.543 0.931 0 CA-C-O 121.844 0.685 . . . . 0.0 113.405 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 15.6 t -124.75 137.88 55.96 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 C-N-CA 125.159 1.384 . . . . 0.0 111.924 175.476 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -68.44 143.27 95.28 Favored Pre-proline 0 CA--C 1.554 1.112 0 O-C-N 121.537 -0.727 . . . . 0.0 112.631 179.086 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 26.6 Cg_endo -76.87 164.52 29.84 Favored 'Trans proline' 0 CA--C 1.548 1.2 0 C-N-CA 122.893 2.395 . . . . 0.0 113.51 177.221 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo . . . . . 0 CA--C 1.541 0.849 0 C-N-CA 123.455 2.77 . . . . 0.0 112.131 176.44 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 517' ' ' LEU . . . . . 0.474 HD22 HD22 ' A' ' 548' ' ' LEU . 11.7 mt . . . . . 0 CA--C 1.553 1.093 0 CA-C-O 120.196 0.046 . . . . 0.0 111.069 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -67.97 160.07 50.15 Favored 'Trans proline' 0 CA--C 1.541 0.842 0 C-N-CA 123.671 2.914 . . . . 0.0 113.222 -177.078 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -62.61 134.15 46.12 Favored 'Trans proline' 0 CA--C 1.535 0.562 0 C-N-CA 123.05 2.5 . . . . 0.0 111.037 -177.598 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 74.42 -2.1 47.7 Favored Glycine 0 CA--C 1.535 1.337 0 CA-C-O 117.628 -1.651 . . . . 0.0 115.751 -178.675 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 31.3 t80 -31.69 123.7 0.27 Allowed 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 117.827 2.528 . . . . 0.0 117.827 -176.795 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 46.2 mtm -94.81 -53.1 3.98 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 112.413 0.523 . . . . 0.0 112.413 -176.095 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 523' ' ' PHE . . . . . 0.402 ' CE2' HG21 ' A' ' 549' ' ' VAL . 28.1 p90 -169.55 174.26 5.99 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 126.556 1.943 . . . . 0.0 112.872 -173.591 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 524' ' ' LYS . . . . . 0.451 ' HG2' HD23 ' A' ' 548' ' ' LEU . 50.9 mttt -106.58 163.81 12.58 Favored 'General case' 0 N--CA 1.47 0.543 0 O-C-N 120.818 -1.176 . . . . 0.0 112.653 169.207 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 12.5 m -133.3 160.91 42.16 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.925 0 C-N-CA 126.626 1.97 . . . . 0.0 110.065 165.413 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 25.6 tt0 -124.5 127.37 47.35 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 119.709 1.14 . . . . 0.0 112.919 172.733 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 527' ' ' ALA . . . . . 0.492 ' HA ' HG22 ' A' ' 589' ' ' THR . . . -64.6 123.71 19.98 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.618 1.167 . . . . 0.0 112.738 -178.45 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 35.5 mm-40 -89.68 -25.35 21.27 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 125.426 1.49 . . . . 0.0 111.87 175.276 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 94.3 m-70 -138.62 164.66 28.91 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 127.745 2.418 . . . . 0.0 110.121 179.915 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -87.73 138.64 31.29 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 107.092 -1.447 . . . . 0.0 107.092 177.098 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 66.9 t80 -127.43 115.74 19.38 Favored 'General case' 0 C--N 1.332 -0.187 0 C-N-CA 125.586 1.555 . . . . 0.0 113.648 -179.194 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -84.15 128.45 34.57 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 114.722 1.379 . . . . 0.0 114.722 -177.56 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -72.11 108.64 5.41 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 121.778 0.799 . . . . 0.0 111.139 -179.309 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 12.3 t -80.53 -17.97 49.91 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 114.388 1.255 . . . . 0.0 114.388 -177.991 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 24.8 m-20 -148.57 168.84 21.71 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 127.205 2.202 . . . . 0.0 114.9 -171.262 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 2.0 t -61.06 -34.78 75.43 Favored 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 117.012 2.227 . . . . 0.0 117.012 -173.284 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 45.3 m-20 -81.34 -15.21 56.04 Favored 'General case' 0 CA--C 1.539 0.558 0 N-CA-C 114.971 1.471 . . . . 0.0 114.971 177.643 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 24.3 mp0 -83.71 134.37 34.76 Favored 'General case' 0 CA--C 1.543 0.707 0 O-C-N 120.873 -1.142 . . . . 0.0 113.849 -166.412 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -83.9 128.63 34.68 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.922 1.689 . . . . 0.0 110.442 178.93 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 8.6 tt0 -90.1 132.41 35.44 Favored 'General case' 0 CA--C 1.537 0.48 0 O-C-N 121.667 -0.645 . . . . 0.0 111.932 177.827 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 73.1 mt -123.68 146.43 48.24 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.722 1.209 . . . . 0.0 112.643 -174.741 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -114.3 141.17 47.93 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 125.05 1.34 . . . . 0.0 110.126 170.272 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -56.2 104.91 0.16 Allowed 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 123.75 0.82 . . . . 0.0 111.895 179.622 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 125.38 -12.74 7.48 Favored Glycine 0 CA--C 1.532 1.147 0 C-N-CA 126.616 2.055 . . . . 0.0 114.296 -174.161 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 90.0 m-20 -74.14 125.43 28.33 Favored 'General case' 0 C--O 1.231 0.12 0 N-CA-C 115.227 1.565 . . . . 0.0 115.227 -173.183 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 2.6 t -73.85 134.33 29.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 C-N-CA 122.921 0.488 . . . . 0.0 111.394 167.041 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 1.4 t -121.92 121.6 64.59 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.593 0 C-N-CA 124.9 1.28 . . . . 0.0 111.308 174.108 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 548' ' ' LEU . . . . . 0.474 HD22 HD22 ' A' ' 517' ' ' LEU . 18.3 mt -77.17 100.22 5.7 Favored 'General case' 0 CA--C 1.539 0.525 0 N-CA-C 108.055 -1.091 . . . . 0.0 108.055 175.895 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 549' ' ' VAL . . . . . 0.402 HG21 ' CE2' ' A' ' 523' ' ' PHE . 4.1 t -62.03 129.31 24.96 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.92 0 N-CA-C 113.652 0.982 . . . . 0.0 113.652 171.572 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 8.3 pt -123.69 154.67 66.9 Favored Pre-proline 0 CA--C 1.54 0.592 0 C-N-CA 125.965 1.706 . . . . 0.0 109.447 179.581 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -65.39 142.28 71.71 Favored 'Trans proline' 0 N--CA 1.458 -0.593 0 C-N-CA 122.711 2.274 . . . . 0.0 110.026 174.686 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 34.5 m-85 . . . . . 0 C--O 1.235 0.335 0 N-CA-C 116.807 2.151 . . . . 0.0 116.807 -175.555 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 49.1 tt0 . . . . . 0 CA--C 1.538 0.497 0 N-CA-C 111.988 0.366 . . . . 0.0 111.988 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -114.73 149.77 36.34 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 126.189 1.795 . . . . 0.0 113.083 171.517 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 57.0 tt0 -69.9 122.99 20.37 Favored 'General case' 0 CA--C 1.538 0.49 0 O-C-N 121.142 -0.974 . . . . 0.0 111.436 -173.493 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 85.43 -2.23 88.13 Favored Glycine 0 CA--C 1.535 1.343 0 C-N-CA 125.059 1.314 . . . . 0.0 115.059 -176.519 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 59.1 m95 -95.08 154.1 17.34 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 126.025 1.73 . . . . 0.0 112.643 174.008 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 13.1 mt -131.04 159.73 36.68 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 123.18 0.592 . . . . 0.0 111.161 168.967 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 48.3 ttm -117.27 139.55 50.67 Favored 'General case' 0 CA--C 1.527 0.091 0 C-N-CA 125.384 1.474 . . . . 0.0 110.712 -179.668 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -170.37 -175.75 39.39 Favored Glycine 0 CA--C 1.523 0.584 0 C-N-CA 123.943 0.783 . . . . 0.0 112.49 -178.896 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 14.9 p -128.04 138.82 53.61 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.444 0 C-N-CA 125.406 1.482 . . . . 0.0 108.578 169.526 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 38.7 mtmt -58.09 134.43 56.43 Favored 'General case' 0 N--CA 1.465 0.307 0 O-C-N 121.377 -0.827 . . . . 0.0 110.559 176.198 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -58.92 -42.99 91.0 Favored 'General case' 0 C--O 1.22 -0.469 0 CA-C-O 118.773 -0.632 . . . . 0.0 109.749 175.552 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 57.4 p -60.0 -22.59 62.77 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 115.508 1.67 . . . . 0.0 115.508 174.074 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 53.9 m-20 -85.13 -45.31 12.19 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.962 1.305 . . . . 0.0 114.219 173.862 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 59.4 t-105 -67.57 -35.86 79.84 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.323 1.449 . . . . 0.0 112.826 174.857 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 9.7 t-20 -77.7 -14.44 59.61 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 126.21 1.804 . . . . 0.0 112.852 175.971 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 57.4 mm-40 -90.81 0.46 57.45 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 125.198 1.399 . . . . 0.0 112.666 162.106 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 93.6 m-70 59.58 34.85 22.46 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 127.871 2.468 . . . . 0.0 114.044 175.894 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 6.6 mtpm? -74.45 147.78 41.68 Favored 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 125.217 1.407 . . . . 0.0 110.659 177.806 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 6.7 pm0 -51.94 103.58 0.07 Allowed 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 126.585 1.954 . . . . 0.0 114.505 -175.397 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 57.5 tp -51.38 -49.63 61.14 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 126.236 1.814 . . . . 0.0 113.27 -171.713 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 92.6 mt-10 -66.02 -13.43 59.91 Favored 'General case' 0 CA--C 1.546 0.805 0 N-CA-C 114.154 1.168 . . . . 0.0 114.154 -175.757 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 33.5 mmtp -106.7 -30.13 9.16 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 125.381 1.472 . . . . 0.0 112.963 171.818 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 84.0 m -82.9 -23.04 33.75 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 114.221 1.193 . . . . 0.0 114.221 -176.965 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 40.3 ptt180 -63.64 162.61 12.77 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.907 1.283 . . . . 0.0 112.753 173.287 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -175.43 176.21 47.31 Favored Glycine 0 CA--C 1.529 0.929 0 CA-C-N 115.282 -0.872 . . . . 0.0 115.132 170.525 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 34.1 m -93.36 140.88 15.61 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 C-N-CA 124.819 1.247 . . . . 0.0 112.242 169.482 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 50.8 p90 -140.37 155.92 69.88 Favored Pre-proline 0 CA--C 1.544 0.721 0 C-N-CA 125.259 1.423 . . . . 0.0 112.484 176.738 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_endo -71.11 112.37 3.29 Favored 'Trans proline' 0 CA--C 1.533 0.467 0 C-N-CA 122.535 2.157 . . . . 0.0 109.667 171.158 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 20.2 pt-20 -57.56 -26.06 60.88 Favored 'General case' 0 N--CA 1.476 0.871 0 O-C-N 121.286 -0.884 . . . . 0.0 112.441 179.906 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 10.1 p-10 -71.75 -10.72 60.19 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 125.683 1.593 . . . . 0.0 114.859 177.268 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 18.6 m-85 -75.65 -13.83 60.34 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 117.003 2.223 . . . . 0.0 117.003 160.051 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 589' ' ' THR . . . . . 0.492 HG22 ' HA ' ' A' ' 527' ' ' ALA . 73.4 p -122.13 175.8 6.17 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 126.339 1.856 . . . . 0.0 110.477 -175.91 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -124.59 137.78 54.37 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 124.145 0.978 . . . . 0.0 108.803 170.003 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.67 125.56 27.78 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 123.742 0.817 . . . . 0.0 109.151 179.666 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 592' ' ' VAL . . . . . . . . . . . . . 7.1 m . . . . . 0 N--CA 1.479 1.022 0 C-N-CA 124.911 1.284 . . . . 0.0 109.774 -175.586 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo . . . . . 0 CA--C 1.54 0.8 0 CA-C-O 121.551 0.563 . . . . 0.0 112.784 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 4.1 t -135.44 135.14 51.97 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 C-N-CA 124.978 1.311 . . . . 0.0 112.83 178.631 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -61.62 136.63 94.69 Favored Pre-proline 0 CA--C 1.554 1.127 0 O-C-N 121.636 -0.665 . . . . 0.0 112.253 178.321 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -71.52 168.08 24.58 Favored 'Trans proline' 0 CA--C 1.543 0.972 0 C-N-CA 123.305 2.67 . . . . 0.0 111.586 171.712 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo . . . . . 0 CA--C 1.542 0.889 0 C-N-CA 122.739 2.293 . . . . 0.0 113.211 -179.564 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 517' ' ' LEU . . . . . 0.418 HD22 HD22 ' A' ' 548' ' ' LEU . 10.5 mt . . . . . 0 CA--C 1.551 0.99 0 N-CA-C 111.945 0.35 . . . . 0.0 111.945 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -69.27 161.35 46.24 Favored 'Trans proline' 0 CA--C 1.537 0.648 0 C-N-CA 124.02 3.146 . . . . 0.0 113.782 -175.643 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 65.8 Cg_endo -61.87 142.06 92.04 Favored 'Trans proline' 0 N--CA 1.458 -0.569 0 C-N-CA 122.732 2.288 . . . . 0.0 110.283 178.139 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 67.37 3.56 26.03 Favored Glycine 0 CA--C 1.533 1.186 0 CA-C-O 117.198 -1.89 . . . . 0.0 116.177 -178.369 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 27.9 t80 -40.56 137.28 1.15 Allowed 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 116.886 2.18 . . . . 0.0 116.886 -178.119 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 57.1 mtm -112.91 -53.87 2.67 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 113.435 0.902 . . . . 0.0 113.435 -174.748 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 523' ' ' PHE . . . . . 0.481 ' CE1' HG21 ' A' ' 549' ' ' VAL . 26.1 p90 -167.36 174.32 8.12 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 126.612 1.965 . . . . 0.0 111.389 -178.205 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 524' ' ' LYS . . . . . 0.483 ' HE2' ' CD2' ' A' ' 548' ' ' LEU . 78.1 mttt -109.41 161.95 14.82 Favored 'General case' 0 N--CA 1.467 0.414 0 O-C-N 121.413 -0.804 . . . . 0.0 111.226 171.759 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 5.6 m -130.23 163.83 34.74 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 C-N-CA 126.261 1.824 . . . . 0.0 110.202 165.411 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 60.8 tt0 -129.52 130.81 46.26 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 118.836 0.744 . . . . 0.0 112.694 169.586 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 527' ' ' ALA . . . . . 0.529 ' HA ' HG22 ' A' ' 589' ' ' THR . . . -64.07 119.14 9.58 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.604 1.162 . . . . 0.0 112.335 -178.06 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 46.9 mm-40 -86.13 -22.23 27.18 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.229 1.411 . . . . 0.0 111.417 171.762 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 89.1 m-70 -140.87 157.69 45.02 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 126.404 1.882 . . . . 0.0 110.455 178.033 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -84.77 141.79 30.27 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 -178.656 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 76.9 t80 -136.45 120.7 17.91 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 125.895 1.678 . . . . 0.0 112.306 -179.532 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 1.9 m -90.37 132.78 35.4 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 114.01 1.115 . . . . 0.0 114.01 175.233 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -67.36 128.45 36.44 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-O 121.588 0.709 . . . . 0.0 112.186 -176.655 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 1.7 p -107.19 -3.64 19.62 Favored 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 116.743 2.127 . . . . 0.0 116.743 -177.647 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 34.9 t0 -143.87 165.78 26.77 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 124.799 1.24 . . . . 0.0 108.984 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 1.5 t -55.83 -35.51 66.46 Favored 'General case' 0 N--CA 1.464 0.271 0 N-CA-C 114.673 1.36 . . . . 0.0 114.673 167.081 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 90.2 m-20 -68.06 -22.71 64.93 Favored 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 117.093 2.257 . . . . 0.0 117.093 176.25 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -88.2 144.8 26.24 Favored 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 115.398 1.629 . . . . 0.0 115.398 -163.137 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -90.28 139.89 30.22 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 127.326 2.25 . . . . 0.0 109.82 177.552 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 15.9 tt0 -91.63 131.13 37.25 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.801 0.84 . . . . 0.0 110.559 171.393 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 80.5 mt -124.89 136.94 54.25 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 124.998 1.319 . . . . 0.0 111.961 -179.916 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 3.3 tppp? -96.27 141.72 29.27 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 125.873 1.669 . . . . 0.0 110.495 163.614 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -57.25 107.73 0.45 Allowed 'General case' 0 CA--C 1.545 0.752 0 CA-C-N 119.281 0.946 . . . . 0.0 109.907 170.163 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 122.46 -11.06 9.11 Favored Glycine 0 CA--C 1.537 1.437 0 C-N-CA 126.546 2.022 . . . . 0.0 114.592 -172.191 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 74.6 m-20 -71.85 124.86 25.75 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 119.835 1.818 . . . . 0.0 115.72 -178.029 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 16.7 t -74.89 133.25 31.88 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 C-N-CA 123.232 0.613 . . . . 0.0 110.369 164.382 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -125.48 122.15 61.92 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.443 0 C-N-CA 125.011 1.324 . . . . 0.0 111.136 175.84 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 548' ' ' LEU . . . . . 0.483 ' CD2' ' HE2' ' A' ' 524' ' ' LYS . 20.8 mt -79.93 103.45 9.82 Favored 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 108.149 -1.056 . . . . 0.0 108.149 177.643 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 549' ' ' VAL . . . . . 0.481 HG21 ' CE1' ' A' ' 523' ' ' PHE . 4.0 t -62.32 126.32 20.33 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.083 0 N-CA-C 113.499 0.926 . . . . 0.0 113.499 172.204 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 20.5 pt -126.43 159.8 61.23 Favored Pre-proline 0 N--CA 1.474 0.744 0 C-N-CA 126.978 2.111 . . . . 0.0 108.94 179.219 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo -72.54 149.74 50.14 Favored 'Trans proline' 0 N--CA 1.456 -0.711 0 C-N-CA 122.948 2.432 . . . . 0.0 112.303 175.362 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 72.0 m-85 . . . . . 0 CA--C 1.533 0.313 0 N-CA-C 113.526 0.936 . . . . 0.0 113.526 167.775 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 54.6 tt0 . . . . . 0 CA--C 1.533 0.31 0 N-CA-C 112.62 0.6 . . . . 0.0 112.62 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 72.5 m-20 -103.99 145.72 29.74 Favored 'General case' 0 CA--C 1.554 1.135 0 C-N-CA 125.684 1.594 . . . . 0.0 113.066 -176.937 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 72.5 tt0 -76.87 107.53 9.26 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 124.786 1.234 . . . . 0.0 112.938 -169.406 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 96.11 1.29 61.27 Favored Glycine 0 CA--C 1.537 1.419 0 C-N-CA 125.072 1.32 . . . . 0.0 114.392 -174.745 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 53.5 m95 -93.53 169.48 10.31 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 126.344 1.857 . . . . 0.0 113.31 176.67 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 16.6 mt -141.38 153.22 44.95 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 125.488 1.515 . . . . 0.0 110.39 165.787 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 57.5 ttm -105.25 142.52 34.87 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 125.396 1.479 . . . . 0.0 112.262 170.575 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -165.24 -174.83 35.31 Favored Glycine 0 CA--C 1.527 0.788 0 C-N-CA 124.946 1.26 . . . . 0.0 112.795 174.566 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 12.7 p -128.92 139.99 50.43 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 C-N-CA 125.127 1.371 . . . . 0.0 109.321 169.777 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 34.9 mtmt -58.02 135.59 56.99 Favored 'General case' 0 N--CA 1.468 0.435 0 O-C-N 121.538 -0.726 . . . . 0.0 110.814 175.407 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -59.22 -38.88 81.05 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-O 118.159 -0.924 . . . . 0.0 111.215 176.768 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 8.7 t -71.77 -32.65 67.9 Favored 'General case' 0 N--CA 1.477 0.89 0 CA-C-N 119.912 1.233 . . . . 0.0 111.782 -179.175 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 71.2 m-20 -61.59 -50.19 73.62 Favored 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 113.669 0.989 . . . . 0.0 113.669 167.751 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 49.8 t-105 -68.04 -33.36 74.42 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 114.305 1.224 . . . . 0.0 114.305 -179.925 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 8.4 t-20 -68.17 -30.16 69.2 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.591 1.157 . . . . 0.0 111.919 178.292 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 41.6 mt-30 -78.3 3.47 15.42 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.489 1.116 . . . . 0.0 112.984 170.764 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 26.0 m-70 61.15 31.46 19.63 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 126.538 1.935 . . . . 0.0 112.897 179.573 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 20.9 mttm -65.11 154.7 37.15 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 123.883 0.873 . . . . 0.0 112.807 179.819 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 9.1 pm0 -53.18 104.74 0.1 Allowed 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 126.152 1.781 . . . . 0.0 112.892 179.573 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 58.2 tp -64.02 -50.08 69.85 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 124.488 1.115 . . . . 0.0 111.917 -166.299 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 16.1 pm0 -61.39 -22.8 65.31 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.285 1.034 . . . . 0.0 113.778 -178.149 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 23.4 tptm -88.46 -55.27 3.79 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 126.062 1.745 . . . . 0.0 111.195 175.124 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 87.8 m -75.0 -19.63 60.0 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 125.155 1.382 . . . . 0.0 114.694 -168.98 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 19.9 ptt180 -64.03 160.47 17.94 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 123.649 0.78 . . . . 0.0 111.61 170.202 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -166.21 172.33 41.5 Favored Glycine 0 CA--C 1.525 0.709 0 CA-C-N 115.142 -0.936 . . . . 0.0 113.158 173.302 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 22.7 m -91.61 145.53 7.39 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.34 0 C-N-CA 124.427 1.091 . . . . 0.0 111.245 168.853 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 47.4 p90 -140.57 155.5 69.63 Favored Pre-proline 0 C--O 1.24 0.6 0 C-N-CA 124.82 1.248 . . . . 0.0 112.664 176.912 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -67.95 109.41 1.92 Allowed 'Trans proline' 0 N--CA 1.457 -0.623 0 C-N-CA 122.0 1.8 . . . . 0.0 109.62 170.503 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 19.2 pt-20 -54.47 -28.02 41.68 Favored 'General case' 0 N--CA 1.476 0.844 0 O-C-N 121.215 -0.928 . . . . 0.0 112.386 -179.627 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 11.6 p-10 -69.07 -13.59 62.53 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 126.143 1.777 . . . . 0.0 114.361 177.554 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 15.0 m-85 -74.39 -12.83 60.62 Favored 'General case' 0 N--CA 1.467 0.382 0 N-CA-C 116.802 2.149 . . . . 0.0 116.802 163.561 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 589' ' ' THR . . . . . 0.529 HG22 ' HA ' ' A' ' 527' ' ' ALA . 73.4 p -123.99 173.99 7.88 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 125.404 1.482 . . . . 0.0 111.679 -172.93 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -119.89 140.99 50.0 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.746 1.218 . . . . 0.0 108.942 169.726 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 15.0 tpt180 -67.44 105.72 1.9 Allowed 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.496 1.119 . . . . 0.0 108.959 171.545 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 592' ' ' VAL . . . . . 0.445 HG23 ' HB2' ' A' ' 524' ' ' LYS . 2.1 m . . . . . 0 CA--C 1.541 0.633 0 C-N-CA 123.637 0.775 . . . . 0.0 109.275 178.963 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo . . . . . 0 CA--C 1.542 0.912 0 N-CA-C 114.039 0.746 . . . . 0.0 114.039 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 29.7 t -133.85 131.51 56.35 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 125.63 1.572 . . . . 0.0 111.429 -179.622 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -65.62 139.47 97.11 Favored Pre-proline 0 CA--C 1.552 1.039 0 O-C-N 121.439 -0.788 . . . . 0.0 112.361 -179.047 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo -75.13 164.94 32.15 Favored 'Trans proline' 0 CA--C 1.547 1.152 0 C-N-CA 123.186 2.59 . . . . 0.0 112.62 175.709 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo . . . . . 0 CA--C 1.541 0.86 0 C-N-CA 123.67 2.913 . . . . 0.0 114.223 174.888 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 517' ' ' LEU . . . . . 0.517 HD22 HD22 ' A' ' 548' ' ' LEU . 14.1 mt . . . . . 0 CA--C 1.545 0.77 0 N-CA-C 111.818 0.303 . . . . 0.0 111.818 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -68.45 159.26 54.18 Favored 'Trans proline' 0 CA--C 1.539 0.771 0 C-N-CA 123.957 3.105 . . . . 0.0 113.38 -172.734 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -61.89 128.42 24.24 Favored 'Trans proline' 0 N--CA 1.459 -0.536 0 C-N-CA 123.218 2.612 . . . . 0.0 111.321 -174.759 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 73.48 5.47 67.85 Favored Glycine 0 CA--C 1.537 1.446 0 CA-C-O 116.865 -2.075 . . . . 0.0 115.805 -177.177 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 22.2 t80 -35.67 133.96 0.37 Allowed 'General case' 0 N--CA 1.471 0.608 0 CA-C-N 120.508 2.154 . . . . 0.0 116.52 177.254 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 53.3 mtm -107.08 -57.45 2.07 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 123.541 0.736 . . . . 0.0 111.701 -177.301 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 523' ' ' PHE . . . . . . . . . . . . . 25.8 p90 -160.25 169.66 22.75 Favored 'General case' 0 C--O 1.222 -0.366 0 C-N-CA 125.168 1.387 . . . . 0.0 114.142 -174.571 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 524' ' ' LYS . . . . . 0.547 ' HG2' HD23 ' A' ' 548' ' ' LEU . 85.3 mttt -102.6 164.19 11.79 Favored 'General case' 0 CA--C 1.538 0.485 0 O-C-N 121.118 -0.989 . . . . 0.0 112.272 168.056 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 10.2 m -136.32 159.49 38.34 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 C-N-CA 127.051 2.14 . . . . 0.0 109.546 165.109 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 45.0 tt0 -123.58 128.57 49.89 Favored 'General case' 0 N--CA 1.475 0.779 0 CA-C-N 119.323 0.965 . . . . 0.0 112.213 168.755 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 527' ' ' ALA . . . . . 0.493 ' HA ' HG22 ' A' ' 589' ' ' THR . . . -64.03 122.61 16.95 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.103 0.961 . . . . 0.0 112.313 -179.275 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 48.5 mm-40 -88.23 -23.18 23.61 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.497 1.519 . . . . 0.0 111.867 174.514 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 93.8 m-70 -139.65 157.74 45.27 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 126.984 2.114 . . . . 0.0 110.206 -175.945 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 34.8 p-10 -87.19 135.65 33.22 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 119.374 0.988 . . . . 0.0 113.22 -179.503 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 83.0 t80 -128.63 110.03 11.87 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 124.6 1.16 . . . . 0.0 111.829 -178.332 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 532' ' ' THR . . . . . . . . . . . . 0.253 0.2 OUTLIER -82.91 113.91 20.84 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 114.148 1.166 . . . . 0.0 114.148 168.677 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -62.02 143.73 56.16 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 123.858 0.863 . . . . 0.0 112.186 175.43 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 534' ' ' THR . . . . . . . . . . . . 0.27 4.6 t -126.23 21.96 7.27 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 127.233 2.213 . . . . 0.0 114.36 179.496 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 38.7 t0 -152.63 156.24 38.88 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 107.565 -1.272 . . . . 0.0 107.565 165.764 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 5.0 t -68.17 -10.39 53.92 Favored 'General case' 0 N--CA 1.476 0.86 0 N-CA-C 114.956 1.465 . . . . 0.0 114.956 167.33 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 39.7 t0 -77.55 -31.03 53.02 Favored 'General case' 0 CA--C 1.553 1.07 0 C-N-CA 125.506 1.523 . . . . 0.0 110.989 167.037 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 82.8 mt-10 -81.52 147.16 29.81 Favored 'General case' 0 CA--C 1.547 0.835 0 O-C-N 120.265 -1.522 . . . . 0.0 113.67 -175.779 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -93.14 139.04 31.01 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 127.068 2.147 . . . . 0.0 110.31 176.027 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 15.6 tt0 -94.72 129.91 41.44 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.408 1.083 . . . . 0.0 111.574 179.423 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 76.7 mt -128.56 148.7 50.78 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.699 1.2 . . . . 0.0 112.86 -176.023 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 12.5 tmtt? -120.41 148.13 44.17 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 126.32 1.848 . . . . 0.0 109.841 169.766 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -56.29 99.5 0.03 OUTLIER 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 123.735 0.814 . . . . 0.0 111.856 174.981 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 127.73 -4.59 7.03 Favored Glycine 0 CA--C 1.537 1.456 0 C-N-CA 126.659 2.076 . . . . 0.0 114.304 -176.282 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 81.6 m-20 -79.33 120.88 24.4 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 119.395 1.597 . . . . 0.0 113.648 -176.018 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 36.6 t -74.49 135.01 28.33 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 CA-C-N 119.138 0.881 . . . . 0.0 110.15 168.695 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -123.1 122.21 64.96 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.508 0 C-N-CA 125.651 1.58 . . . . 0.0 111.496 174.549 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 548' ' ' LEU . . . . . 0.547 HD23 ' HG2' ' A' ' 524' ' ' LYS . 42.4 mt -78.44 101.2 7.18 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.457 1.103 . . . . 0.0 108.318 175.279 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 549' ' ' VAL . . . . . . . . . . . . . 4.4 t -63.97 131.49 29.62 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.337 0 N-CA-C 114.844 1.424 . . . . 0.0 114.844 173.313 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 15.8 pt -131.93 154.76 81.84 Favored Pre-proline 0 CA--C 1.548 0.903 0 C-N-CA 126.383 1.873 . . . . 0.0 111.28 -178.78 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -72.81 149.18 47.56 Favored 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 124.321 3.347 . . . . 0.0 111.785 173.597 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 63.6 m-85 . . . . . 0 CA--C 1.539 0.543 0 N-CA-C 114.897 1.443 . . . . 0.0 114.897 -178.656 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 39.9 tt0 . . . . . 0 CA--C 1.537 0.469 0 N-CA-C 114.152 1.167 . . . . 0.0 114.152 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 54.5 m-20 -93.36 150.25 20.61 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 126.183 1.793 . . . . 0.0 111.726 174.677 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 30.7 tp10 -80.8 127.99 33.15 Favored 'General case' 0 N--CA 1.474 0.726 0 O-C-N 120.968 -1.083 . . . . 0.0 110.895 -177.334 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 83.88 4.9 88.4 Favored Glycine 0 CA--C 1.538 1.501 0 O-C-N 121.327 -0.858 . . . . 0.0 114.705 -173.153 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 562' ' ' TRP . . . . . 0.411 ' CZ2' ' HB1' ' B' 1733 ' ' ALA . 50.2 m95 -110.74 157.38 19.83 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 127.019 2.128 . . . . 0.0 112.598 178.401 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 11.5 mt -133.15 153.74 51.25 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 123.286 0.634 . . . . 0.0 110.992 173.564 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 41.9 ttm -106.37 142.76 35.51 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 123.997 0.919 . . . . 0.0 112.136 177.123 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -165.25 -170.34 30.07 Favored Glycine 0 CA--C 1.525 0.697 0 C-N-CA 124.282 0.944 . . . . 0.0 112.309 173.69 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 14.3 p -134.41 140.7 45.34 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.502 0 C-N-CA 125.966 1.707 . . . . 0.0 108.993 170.884 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 41.7 mtmt -62.42 134.76 56.89 Favored 'General case' 0 N--CA 1.465 0.304 0 O-C-N 121.139 -0.976 . . . . 0.0 112.064 176.636 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -57.36 -43.06 83.2 Favored 'General case' 0 C--O 1.222 -0.375 0 CA-C-O 118.12 -0.943 . . . . 0.0 111.391 -177.006 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 33.2 t -62.62 -33.1 74.32 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 119.358 0.981 . . . . 0.0 113.529 -178.849 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -69.69 -45.95 67.12 Favored 'General case' 0 CA--C 1.542 0.672 0 O-C-N 120.835 -1.166 . . . . 0.0 108.812 176.19 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 66.1 t-105 -66.72 -36.3 82.16 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 124.329 1.052 . . . . 0.0 112.525 179.49 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -67.78 -31.27 71.04 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 126.288 1.835 . . . . 0.0 111.783 175.213 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 44.1 mt-30 -77.09 -0.63 25.48 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.609 1.164 . . . . 0.0 113.73 172.287 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 67.0 m-70 68.37 18.85 9.05 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 127.99 2.516 . . . . 0.0 115.119 -178.406 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 6.7 mtpm? -76.34 160.71 29.35 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 125.233 1.413 . . . . 0.0 112.987 -173.982 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 18.1 pm0 -58.72 127.29 31.43 Favored 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 114.189 1.181 . . . . 0.0 114.189 -175.059 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 62.0 tp -75.31 -45.81 37.3 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 125.405 1.482 . . . . 0.0 111.891 -173.622 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 23.9 pt-20 -62.81 -18.33 62.61 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 113.856 1.058 . . . . 0.0 113.856 -174.506 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 4.2 tppp? -95.07 -41.57 9.05 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 126.065 1.746 . . . . 0.0 113.715 176.982 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 48.3 t -78.25 -28.18 47.7 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 118.568 0.622 . . . . 0.0 112.479 -179.796 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 50.7 ptt85 -54.08 149.47 9.35 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-O 121.74 0.781 . . . . 0.0 112.382 -179.74 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -172.47 170.73 43.77 Favored Glycine 0 N--CA 1.462 0.427 0 CA-C-N 115.358 -0.837 . . . . 0.0 114.348 177.025 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 17.6 m -91.91 136.78 23.59 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.252 0 C-N-CA 124.782 1.233 . . . . 0.0 111.43 171.854 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 44.6 p90 -132.57 154.79 81.65 Favored Pre-proline 0 CA--C 1.539 0.536 0 C-N-CA 124.358 1.063 . . . . 0.0 112.968 175.711 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -68.46 110.78 2.36 Favored 'Trans proline' 0 N--CA 1.457 -0.655 0 C-N-CA 122.262 1.975 . . . . 0.0 110.02 169.702 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 21.3 pt-20 -55.79 -29.49 59.77 Favored 'General case' 0 CA--C 1.547 0.855 0 O-C-N 121.416 -0.802 . . . . 0.0 112.233 -179.832 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 9.7 p-10 -67.22 -8.7 33.55 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 126.141 1.776 . . . . 0.0 114.523 179.446 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 17.1 m-85 -82.68 -11.9 58.0 Favored 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 116.783 2.142 . . . . 0.0 116.783 166.622 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 589' ' ' THR . . . . . 0.493 HG22 ' HA ' ' A' ' 527' ' ' ALA . 60.4 p -122.77 173.23 7.88 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 125.511 1.525 . . . . 0.0 111.528 -171.881 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -124.14 139.45 53.91 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.061 0.945 . . . . 0.0 108.997 170.13 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.82 136.23 57.25 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 125.149 1.379 . . . . 0.0 109.127 177.225 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 592' ' ' VAL . . . . . 0.524 HG23 ' HB2' ' A' ' 524' ' ' LYS . 2.4 m . . . . . 0 N--CA 1.481 1.115 0 C-N-CA 124.78 1.232 . . . . 0.0 109.486 177.783 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo . . . . . 0 CA--C 1.542 0.879 0 CA-C-O 121.095 0.373 . . . . 0.0 112.966 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 2.9 t -132.49 138.86 51.24 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 C-N-CA 125.777 1.631 . . . . 0.0 112.96 178.869 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B 1733 ' ' ALA . . . . . 0.411 ' HB1' ' CZ2' ' A' ' 562' ' ' TRP . . . -72.63 139.7 80.99 Favored Pre-proline 0 CA--C 1.555 1.135 0 O-C-N 120.763 -1.211 . . . . 0.0 112.759 -176.558 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo -76.23 165.45 29.45 Favored 'Trans proline' 0 CA--C 1.553 1.428 0 C-N-CA 123.049 2.5 . . . . 0.0 114.181 -177.442 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 34.5 Cg_exo . . . . . 0 C--N 1.351 0.703 0 C-N-CA 123.999 3.133 . . . . 0.0 114.207 179.723 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 517' ' ' LEU . . . . . 0.52 HD22 HD22 ' A' ' 548' ' ' LEU . 14.9 mt . . . . . 0 CA--C 1.551 0.992 0 N-CA-C 112.605 0.595 . . . . 0.0 112.605 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_endo -67.8 162.14 40.86 Favored 'Trans proline' 0 CA--C 1.539 0.775 0 C-N-CA 123.755 2.97 . . . . 0.0 114.055 -176.056 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -64.11 138.67 63.0 Favored 'Trans proline' 0 C--N 1.348 0.546 0 C-N-CA 122.78 2.32 . . . . 0.0 109.89 176.348 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 70.58 4.72 53.69 Favored Glycine 0 CA--C 1.532 1.114 0 CA-C-O 117.638 -1.646 . . . . 0.0 115.69 -176.016 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 48.8 t80 -44.72 129.87 7.03 Favored 'General case' 0 C--O 1.238 0.494 0 CA-C-N 120.82 2.31 . . . . 0.0 115.216 179.697 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 60.1 mtm -105.36 -59.09 1.81 Allowed 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 123.883 0.873 . . . . 0.0 111.932 -179.151 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 523' ' ' PHE . . . . . 0.573 ' CD1' ' HD3' ' A' ' 591' ' ' ARG . 32.5 p90 -160.34 175.45 12.82 Favored 'General case' 0 C--O 1.224 -0.252 0 C-N-CA 126.155 1.782 . . . . 0.0 112.406 -175.555 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 524' ' ' LYS . . . . . 0.517 ' HG2' HD23 ' A' ' 548' ' ' LEU . 81.3 mttt -106.51 164.09 12.34 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 121.023 -1.048 . . . . 0.0 112.65 171.332 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 12.0 m -131.62 160.94 42.02 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 C-N-CA 126.145 1.778 . . . . 0.0 109.552 164.377 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 45.2 tt0 -122.19 128.03 50.72 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 118.613 0.642 . . . . 0.0 111.423 166.986 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 527' ' ' ALA . . . . . 0.402 ' HA ' HG22 ' A' ' 589' ' ' THR . . . -56.63 123.35 14.55 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.241 1.016 . . . . 0.0 111.209 173.049 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 42.3 mm-40 -84.84 -27.45 26.74 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.153 1.381 . . . . 0.0 110.91 168.596 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 46.9 m80 -139.34 160.18 40.43 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 127.065 2.146 . . . . 0.0 111.657 -174.23 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . 0.314 1.6 p30 -84.19 138.2 33.11 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 115.713 1.746 . . . . 0.0 115.713 178.932 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 89.3 t80 -138.25 128.33 25.69 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.609 1.564 . . . . 0.0 114.298 -176.147 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -90.8 128.2 36.62 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 124.7 1.2 . . . . 0.0 114.189 175.03 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -69.99 121.78 18.07 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 119.161 0.891 . . . . 0.0 110.822 173.032 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 12.2 t -88.51 -20.55 24.97 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 115.049 1.5 . . . . 0.0 115.049 -177.766 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 18.8 m-20 -145.18 177.5 8.75 Favored 'General case' 0 CA--C 1.554 1.11 0 N-CA-C 116.872 2.175 . . . . 0.0 116.872 -165.856 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 5.3 t -59.37 -17.81 33.28 Favored 'General case' 0 N--CA 1.481 1.09 0 N-CA-C 119.141 3.015 . . . . 0.0 119.141 -173.67 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . 0.287 18.8 m-20 -129.14 16.73 6.14 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 125.9 1.68 . . . . 0.0 115.18 175.776 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 20.0 mp0 -95.67 145.0 25.61 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.947 1.299 . . . . 0.0 112.797 -174.985 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -99.61 128.72 45.72 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 125.194 1.398 . . . . 0.0 111.538 -172.979 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 38.0 tt0 -84.64 124.95 32.04 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 124.843 1.257 . . . . 0.0 110.396 176.982 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 79.9 mt -125.12 145.99 49.68 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 124.925 1.29 . . . . 0.0 112.275 -178.933 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -115.11 143.73 44.75 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 125.817 1.647 . . . . 0.0 109.367 168.829 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -55.72 110.12 0.67 Allowed 'General case' 0 CA--C 1.545 0.777 0 CA-C-N 118.503 0.592 . . . . 0.0 110.705 179.736 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 115.78 -5.58 20.54 Favored Glycine 0 CA--C 1.538 1.488 0 C-N-CA 126.415 1.96 . . . . 0.0 114.618 -174.796 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 83.2 m-20 -72.82 124.64 25.79 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 115.794 1.775 . . . . 0.0 115.794 -176.906 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 41.7 t -72.84 133.71 31.22 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 C-N-CA 123.68 0.792 . . . . 0.0 110.156 169.116 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 1.5 t -128.07 123.66 60.99 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.328 0 C-N-CA 124.57 1.148 . . . . 0.0 111.527 174.301 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 548' ' ' LEU . . . . . 0.52 HD22 HD22 ' A' ' 517' ' ' LEU . 30.1 mt -79.98 100.47 8.14 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.004 1.322 . . . . 0.0 108.55 177.465 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 549' ' ' VAL . . . . . 0.41 HG21 ' CE1' ' A' ' 523' ' ' PHE . 7.1 t -61.1 132.14 26.46 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.267 0 N-CA-C 114.924 1.453 . . . . 0.0 114.924 173.928 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 20.9 pt -129.99 157.45 76.9 Favored Pre-proline 0 CA--C 1.551 0.981 0 C-N-CA 127.098 2.159 . . . . 0.0 109.873 174.924 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -73.66 154.69 49.56 Favored 'Trans proline' 0 CA--C 1.536 0.601 0 C-N-CA 124.021 3.147 . . . . 0.0 112.094 174.911 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 36.8 m-85 . . . . . 0 CA--C 1.541 0.605 0 N-CA-C 117.195 2.294 . . . . 0.0 117.195 176.395 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 . . . . . 0 N--CA 1.467 0.386 0 N-CA-C 113.375 0.88 . . . . 0.0 113.375 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . 0.292 18.5 m-20 -96.6 140.03 31.81 Favored 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 116.554 2.057 . . . . 0.0 116.554 -179.175 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 54.9 tp10 -73.88 120.81 19.98 Favored 'General case' 0 CA--C 1.539 0.537 0 O-C-N 120.955 -1.091 . . . . 0.0 112.078 -173.563 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 87.82 3.12 80.63 Favored Glycine 0 CA--C 1.536 1.36 0 C-N-CA 124.514 1.054 . . . . 0.0 114.599 -172.68 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 57.1 m95 -100.98 164.52 11.78 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.569 1.548 . . . . 0.0 112.919 176.284 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 11.6 mt -137.77 152.4 49.13 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 124.943 1.297 . . . . 0.0 109.831 168.699 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 52.1 ttm -108.1 141.97 39.0 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 124.306 1.042 . . . . 0.0 111.503 172.516 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -169.85 -171.79 35.74 Favored Glycine 0 CA--C 1.526 0.767 0 C-N-CA 124.543 1.068 . . . . 0.0 112.666 176.188 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 14.7 p -132.65 138.54 51.79 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 C-N-CA 125.66 1.584 . . . . 0.0 108.893 171.085 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 37.9 mtmt -59.09 139.42 56.89 Favored 'General case' 0 N--CA 1.467 0.42 0 O-C-N 121.224 -0.922 . . . . 0.0 111.167 176.052 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 14.1 tt0 -60.0 -43.19 95.37 Favored 'General case' 0 C--O 1.222 -0.379 0 CA-C-O 119.008 -0.52 . . . . 0.0 110.742 176.524 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 76.4 p -60.05 -34.62 73.66 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 114.403 1.26 . . . . 0.0 114.403 176.467 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 40.9 m-20 -71.15 -45.84 62.71 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.281 1.432 . . . . 0.0 113.893 173.719 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 56.6 t-105 -71.46 -34.79 70.54 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 125.065 1.346 . . . . 0.0 113.834 178.332 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 33.6 t-20 -67.61 -21.81 65.39 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 125.586 1.554 . . . . 0.0 111.881 176.747 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 23.6 mm-40 -89.02 6.51 39.36 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.816 1.246 . . . . 0.0 114.279 169.411 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 2.2 m-70 61.92 23.57 13.89 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 125.79 1.636 . . . . 0.0 113.938 171.66 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 19.2 mtpp -74.56 168.48 19.68 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 125.931 1.693 . . . . 0.0 113.016 -175.774 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 8.3 pm0 -56.72 97.66 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.974 1.71 . . . . 0.0 113.327 -176.632 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 60.6 tp -54.23 -43.26 70.7 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.328 1.451 . . . . 0.0 111.906 -173.807 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -63.01 -33.85 76.31 Favored 'General case' 0 N--CA 1.476 0.859 0 N-CA-C 113.131 0.789 . . . . 0.0 113.131 -176.743 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 29.6 mmtp -88.49 -39.05 14.49 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 123.673 0.789 . . . . 0.0 112.511 175.981 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 93.6 m -71.83 -35.09 69.79 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 113.274 0.842 . . . . 0.0 113.274 -177.176 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.13 169.98 1.83 Allowed 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.174 0.99 . . . . 0.0 112.07 176.918 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -178.78 177.56 48.49 Favored Glycine 0 N--CA 1.45 -0.399 0 CA-C-N 114.606 -1.179 . . . . 0.0 114.414 166.978 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 19.3 m -88.88 141.61 14.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 C-N-CA 124.66 1.184 . . . . 0.0 111.542 166.227 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 39.8 p90 -136.5 154.06 76.55 Favored Pre-proline 0 CA--C 1.538 0.518 0 C-N-CA 125.395 1.478 . . . . 0.0 112.187 175.149 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -65.9 112.45 2.24 Favored 'Trans proline' 0 N--CA 1.46 -0.479 0 C-N-CA 121.788 1.659 . . . . 0.0 108.898 170.134 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 18.7 pt-20 -56.28 -30.8 62.96 Favored 'General case' 0 N--CA 1.471 0.604 0 O-C-N 121.346 -0.846 . . . . 0.0 111.459 -178.015 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 8.4 p-10 -63.49 -18.16 63.51 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 126.081 1.752 . . . . 0.0 113.914 178.667 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 9.5 m-85 -74.39 -13.97 60.8 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 116.125 1.898 . . . . 0.0 116.125 166.98 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 589' ' ' THR . . . . . 0.402 HG22 ' HA ' ' A' ' 527' ' ' ALA . 30.9 p -121.76 176.67 5.62 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 127.043 2.137 . . . . 0.0 112.199 -176.682 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 15.8 pt-20 -131.69 138.51 48.73 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.757 1.223 . . . . 0.0 109.808 168.476 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 591' ' ' ARG . . . . . 0.573 ' HD3' ' CD1' ' A' ' 523' ' ' PHE . 4.0 tpt180 -66.1 120.82 13.85 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 125.304 1.442 . . . . 0.0 111.294 176.252 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 592' ' ' VAL . . . . . 0.443 HG23 ' HB2' ' A' ' 524' ' ' LYS . 3.8 m . . . . . 0 N--CA 1.477 0.915 0 C-N-CA 125.241 1.416 . . . . 0.0 109.328 -178.154 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo . . . . . 0 CA--C 1.54 0.804 0 CA-C-O 121.493 0.539 . . . . 0.0 112.713 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 31.6 t -129.78 132.38 65.94 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 C-N-CA 125.73 1.612 . . . . 0.0 110.697 176.745 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -67.4 144.97 98.31 Favored Pre-proline 0 CA--C 1.549 0.939 0 N-CA-C 113.077 0.769 . . . . 0.0 113.077 -172.69 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -77.99 168.66 21.72 Favored 'Trans proline' 0 CA--C 1.548 1.183 0 C-N-CA 122.949 2.433 . . . . 0.0 112.391 175.35 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 77.8 Cg_exo . . . . . 0 CA--C 1.542 0.906 0 C-N-CA 123.719 2.946 . . . . 0.0 114.357 177.247 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 517' ' ' LEU . . . . . 0.45 HD22 HD22 ' A' ' 548' ' ' LEU . 9.3 mt . . . . . 0 CA--C 1.541 0.632 0 CA-C-O 119.511 -0.281 . . . . 0.0 111.197 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 29.9 Cg_endo -67.89 157.44 61.79 Favored 'Trans proline' 0 CA--C 1.541 0.834 0 C-N-CA 123.362 2.708 . . . . 0.0 113.791 -171.209 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_endo -62.46 127.51 21.06 Favored 'Trans proline' 0 N--CA 1.459 -0.551 0 C-N-CA 123.584 2.856 . . . . 0.0 110.074 179.406 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 76.46 1.92 72.5 Favored Glycine 0 CA--C 1.532 1.155 0 CA-C-O 117.616 -1.658 . . . . 0.0 115.785 -175.711 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 30.1 t80 -36.78 128.28 0.85 Allowed 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 116.912 2.19 . . . . 0.0 116.912 178.013 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 52.3 mtm -100.11 -55.1 2.71 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 123.081 0.552 . . . . 0.0 112.178 -178.489 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 523' ' ' PHE . . . . . . . . . . . . . 24.6 p90 -165.62 170.38 14.27 Favored 'General case' 0 C--O 1.222 -0.345 0 C-N-CA 126.323 1.849 . . . . 0.0 112.654 -172.936 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 524' ' ' LYS . . . . . 0.52 ' HE2' ' CD2' ' A' ' 548' ' ' LEU . 78.5 mttt -102.18 162.9 12.56 Favored 'General case' 0 CA--C 1.538 0.483 0 O-C-N 121.169 -0.957 . . . . 0.0 111.807 169.298 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 17.7 m -136.24 160.98 38.08 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.904 0 C-N-CA 127.21 2.204 . . . . 0.0 108.788 166.19 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 41.3 tt0 -126.23 125.99 43.3 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 119.204 0.911 . . . . 0.0 111.587 175.347 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 527' ' ' ALA . . . . . 0.505 ' HA ' HG22 ' A' ' 589' ' ' THR . . . -58.24 132.84 54.78 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 124.011 0.924 . . . . 0.0 111.391 -179.783 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 84.0 mm-40 -102.46 -23.8 13.89 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 125.941 1.696 . . . . 0.0 112.179 173.201 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 89.9 m-70 -138.13 160.07 40.38 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 126.254 1.822 . . . . 0.0 111.01 -179.05 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -83.1 128.22 34.29 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 125.28 1.432 . . . . 0.0 113.966 -178.912 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 84.9 t80 -130.69 122.65 27.71 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 115.107 1.521 . . . . 0.0 115.107 -176.973 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -95.68 134.77 38.2 Favored 'General case' 0 N--CA 1.48 1.069 0 N-CA-C 115.652 1.723 . . . . 0.0 115.652 174.114 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -74.59 120.51 20.24 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-O 122.12 0.962 . . . . 0.0 112.947 -175.817 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 4.4 t -90.79 6.98 42.05 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 126.836 2.054 . . . . 0.0 115.84 179.894 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -153.23 155.13 36.04 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 129.172 2.989 . . . . 0.0 111.685 -178.61 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 536' ' ' THR . . . . . . . . . . . . 0.264 0.9 OUTLIER -65.38 -25.56 67.62 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 116.124 1.898 . . . . 0.0 116.124 177.16 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 90.2 m-20 -92.74 -8.58 43.39 Favored 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 115.47 1.656 . . . . 0.0 115.47 175.594 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -74.47 146.46 42.77 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.767 1.227 . . . . 0.0 110.909 174.447 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -84.9 159.4 20.34 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 126.398 1.879 . . . . 0.0 110.202 174.637 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 17.8 tt0 -118.84 138.6 52.61 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.454 1.502 . . . . 0.0 110.658 173.844 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 91.3 mt -133.2 141.23 47.98 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 125.082 1.353 . . . . 0.0 111.953 -174.79 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.23 143.28 40.61 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 125.063 1.345 . . . . 0.0 108.507 164.812 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -53.83 117.8 3.46 Favored 'General case' 0 CA--C 1.548 0.894 0 O-C-N 121.633 -0.667 . . . . 0.0 111.94 -179.868 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 110.85 -9.71 29.77 Favored Glycine 0 CA--C 1.532 1.109 0 C-N-CA 126.772 2.13 . . . . 0.0 113.939 -175.347 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 69.0 m-20 -74.83 121.44 21.82 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 118.689 1.245 . . . . 0.0 113.377 -173.881 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 2.7 t -72.31 136.1 26.37 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 O-C-N 121.713 -0.617 . . . . 0.0 112.071 172.393 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -124.08 122.27 63.99 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.6 0 C-N-CA 126.16 1.784 . . . . 0.0 111.428 175.93 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 548' ' ' LEU . . . . . 0.52 ' CD2' ' HE2' ' A' ' 524' ' ' LYS . 20.0 mt -78.37 99.42 6.36 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.637 1.175 . . . . 0.0 108.637 174.983 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 549' ' ' VAL . . . . . . . . . . . . . 6.1 t -60.92 133.12 26.7 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.268 0 N-CA-C 114.583 1.327 . . . . 0.0 114.583 172.984 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 16.8 pt -130.42 156.17 79.95 Favored Pre-proline 0 CA--C 1.55 0.958 0 C-N-CA 126.77 2.028 . . . . 0.0 110.428 177.965 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 92.3 Cg_endo -72.19 165.55 32.3 Favored 'Trans proline' 0 CA--C 1.536 0.596 0 C-N-CA 124.194 3.263 . . . . 0.0 111.638 173.024 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 66.0 m-85 . . . . . 0 CA--C 1.535 0.389 0 N-CA-C 116.28 1.956 . . . . 0.0 116.28 -177.692 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 4.5 tp60 . . . . . 0 CA--C 1.54 0.579 0 CA-C-O 121.898 0.856 . . . . 0.0 112.072 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -113.33 141.9 46.49 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 128.146 2.578 . . . . 0.0 113.607 171.169 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 82.5 tt0 -64.42 120.34 12.08 Favored 'General case' 0 N--CA 1.478 0.948 0 O-C-N 119.654 -1.904 . . . . 0.0 112.032 -171.168 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 85.13 5.71 85.42 Favored Glycine 0 CA--C 1.539 1.576 0 C-N-CA 124.897 1.237 . . . . 0.0 115.826 -175.42 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 41.1 m95 -94.33 173.21 7.75 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 125.386 1.474 . . . . 0.0 113.86 178.396 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 17.3 mt -139.92 154.34 47.21 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 125.137 1.375 . . . . 0.0 110.618 166.704 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 31.4 tpp -107.34 143.33 35.78 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 125.28 1.432 . . . . 0.0 110.932 168.731 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -169.41 -172.42 36.04 Favored Glycine 0 CA--C 1.526 0.742 0 C-N-CA 124.38 0.991 . . . . 0.0 112.607 174.376 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 12.0 p -134.22 140.41 46.13 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.568 0 C-N-CA 125.569 1.548 . . . . 0.0 109.124 173.586 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 35.9 mtmt -56.39 136.16 53.79 Favored 'General case' 0 N--CA 1.468 0.428 0 O-C-N 121.24 -0.913 . . . . 0.0 111.356 176.347 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 52.3 tt0 -61.57 -42.41 98.8 Favored 'General case' 0 C--O 1.22 -0.449 0 CA-C-O 117.868 -1.063 . . . . 0.0 110.71 176.355 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 40.1 t -58.58 -37.2 75.26 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 119.696 1.135 . . . . 0.0 112.501 174.634 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 73.6 m-20 -63.75 -44.27 94.0 Favored 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 114.771 1.397 . . . . 0.0 114.771 172.516 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 55.3 t-105 -75.35 -29.36 59.91 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 124.941 1.296 . . . . 0.0 113.634 177.953 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 5.6 t-20 -68.44 -33.51 74.34 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 126.638 1.975 . . . . 0.0 110.711 172.873 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 30.5 mm100 -79.06 -3.7 46.54 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 124.636 1.174 . . . . 0.0 113.92 167.945 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 574' ' ' HIS . . . . . . . . . . . . 0.283 86.4 m-70 64.13 31.93 13.0 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 127.605 2.362 . . . . 0.0 115.547 168.65 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 78.2 mttt -66.6 170.87 5.69 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 127.566 2.346 . . . . 0.0 114.108 -178.225 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 21.4 pt-20 -59.95 104.65 0.32 Allowed 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 124.629 1.172 . . . . 0.0 113.031 171.738 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 57.7 tp -55.74 -42.84 75.98 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 124.226 1.01 . . . . 0.0 112.421 -171.204 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 2.8 pt-20 -61.86 -30.48 70.88 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 114.73 1.381 . . . . 0.0 114.73 -176.131 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 28.2 mmmt -97.47 -30.68 12.76 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 123.547 0.739 . . . . 0.0 112.819 -179.677 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 32.8 m -70.27 -40.39 74.36 Favored 'General case' 0 CA--C 1.538 0.492 0 N-CA-C 113.507 0.928 . . . . 0.0 113.507 173.141 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 29.6 ptt85 -64.39 161.81 16.26 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 123.867 0.867 . . . . 0.0 112.781 178.374 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -175.44 173.39 46.21 Favored Glycine 0 CA--C 1.52 0.354 0 CA-C-N 115.4 -0.818 . . . . 0.0 114.032 174.15 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 30.1 m -87.87 143.7 10.74 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.274 0 C-N-CA 123.262 0.625 . . . . 0.0 110.199 171.76 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 45.4 p90 -143.55 156.58 60.02 Favored Pre-proline 0 CA--C 1.541 0.629 0 C-N-CA 124.742 1.217 . . . . 0.0 112.346 176.7 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -69.75 111.21 2.75 Favored 'Trans proline' 0 C--N 1.347 0.49 0 C-N-CA 122.291 1.994 . . . . 0.0 109.903 172.762 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 19.6 pt-20 -55.82 -29.71 60.23 Favored 'General case' 0 N--CA 1.475 0.806 0 O-C-N 121.547 -0.721 . . . . 0.0 112.076 -179.07 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 10.9 p-10 -66.32 -20.97 66.24 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 125.604 1.561 . . . . 0.0 114.001 178.612 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 14.0 m-85 -69.07 -14.46 63.03 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 116.717 2.117 . . . . 0.0 116.717 164.605 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 589' ' ' THR . . . . . 0.505 HG22 ' HA ' ' A' ' 527' ' ' ALA . 63.5 p -122.0 173.43 7.54 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 126.277 1.831 . . . . 0.0 111.097 -176.357 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 15.1 pt-20 -126.55 136.34 52.44 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 124.245 1.018 . . . . 0.0 109.001 173.474 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.41 128.22 35.6 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 124.247 1.019 . . . . 0.0 108.692 178.606 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 592' ' ' VAL . . . . . 0.459 HG23 ' HB2' ' A' ' 524' ' ' LYS . 1.9 m . . . . . 0 CA--C 1.548 0.886 0 C-N-CA 125.624 1.57 . . . . 0.0 107.666 178.019 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 68.5 Cg_endo . . . . . 0 CA--C 1.543 0.974 0 N-CA-C 113.633 0.589 . . . . 0.0 113.633 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 16.0 t -128.74 126.14 64.51 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.126 0 C-N-CA 125.194 1.398 . . . . 0.0 112.495 -177.081 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -65.79 129.12 94.25 Favored Pre-proline 0 CA--C 1.55 0.969 0 O-C-N 121.533 -0.729 . . . . 0.0 111.475 -178.542 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 26.6 Cg_endo -69.42 157.16 62.07 Favored 'Trans proline' 0 CA--C 1.544 0.985 0 C-N-CA 122.165 1.91 . . . . 0.0 112.718 -173.847 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo . . . . . 0 CA--C 1.538 0.682 0 C-N-CA 123.054 2.503 . . . . 0.0 111.944 -174.809 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 517' ' ' LEU . . . . . 0.475 HD22 HD22 ' A' ' 548' ' ' LEU . 14.0 mt . . . . . 0 CA--C 1.543 0.687 0 N-CA-C 113.419 0.896 . . . . 0.0 113.419 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_endo -66.2 159.53 49.29 Favored 'Trans proline' 0 CA--C 1.538 0.708 0 C-N-CA 123.923 3.082 . . . . 0.0 114.241 -174.039 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 96.1 Cg_endo -68.36 130.15 20.56 Favored 'Trans proline' 0 N--CA 1.457 -0.622 0 C-N-CA 123.366 2.71 . . . . 0.0 109.628 -179.742 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 78.84 1.23 83.9 Favored Glycine 0 CA--C 1.537 1.454 0 CA-C-O 116.777 -2.124 . . . . 0.0 115.578 -175.441 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 22.2 t80 -36.42 133.13 0.54 Allowed 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 117.63 2.456 . . . . 0.0 117.63 -179.751 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 31.0 mtm -100.58 -57.78 2.04 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 123.065 0.546 . . . . 0.0 111.949 -177.005 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 523' ' ' PHE . . . . . 0.463 ' CE1' HG21 ' A' ' 549' ' ' VAL . 20.3 p90 -166.68 175.09 8.15 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 126.911 2.084 . . . . 0.0 112.46 -173.233 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 524' ' ' LYS . . . . . 0.498 ' HG2' HD23 ' A' ' 548' ' ' LEU . 66.6 mttt -107.35 162.69 13.68 Favored 'General case' 0 N--CA 1.476 0.867 0 O-C-N 120.169 -1.582 . . . . 0.0 112.178 168.629 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 5.1 m -133.33 162.5 39.68 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 C-N-CA 126.905 2.082 . . . . 0.0 109.768 164.057 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 42.5 tt0 -128.71 130.45 47.15 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-N 118.868 0.758 . . . . 0.0 111.924 169.305 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 527' ' ' ALA . . . . . 0.519 ' HA ' HG22 ' A' ' 589' ' ' THR . . . -60.92 127.36 31.18 Favored 'General case' 0 N--CA 1.466 0.353 0 O-C-N 121.124 -0.985 . . . . 0.0 111.548 -179.677 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 61.6 mm-40 -89.94 -25.45 20.92 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 125.308 1.443 . . . . 0.0 111.973 171.984 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 96.5 m-70 -142.44 163.77 31.94 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 126.974 2.109 . . . . 0.0 110.257 -172.944 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 35.8 m-20 -80.03 137.4 36.8 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 123.845 0.858 . . . . 0.0 111.726 177.474 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 89.2 t80 -134.36 121.3 20.99 Favored 'General case' 0 C--O 1.236 0.358 0 N-CA-C 114.065 1.135 . . . . 0.0 114.065 175.18 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -88.22 117.11 26.9 Favored 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 115.289 1.589 . . . . 0.0 115.289 173.701 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -67.77 123.68 21.2 Favored 'General case' 0 CA--C 1.537 0.468 0 O-C-N 121.898 -0.501 . . . . 0.0 110.902 171.336 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 6.2 t -115.9 -2.04 12.43 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 126.575 1.95 . . . . 0.0 114.242 -177.281 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 39.5 m-20 -113.73 156.56 23.58 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 125.713 1.605 . . . . 0.0 115.108 157.135 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 6.7 t -59.26 -29.09 67.31 Favored 'General case' 0 CA--C 1.545 0.785 0 N-CA-C 114.33 1.234 . . . . 0.0 114.33 170.584 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -70.42 -20.17 62.94 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 116.862 2.171 . . . . 0.0 116.862 169.467 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 82.1 mt-10 -85.05 149.93 25.22 Favored 'General case' 0 CA--C 1.542 0.651 0 O-C-N 120.671 -1.268 . . . . 0.0 113.95 -170.453 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -99.89 127.83 46.03 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 126.531 1.932 . . . . 0.0 110.663 179.134 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 14.1 tt0 -88.11 127.85 35.42 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 123.47 0.708 . . . . 0.0 111.473 -179.517 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 71.1 mt -119.34 140.7 49.91 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 124.58 1.152 . . . . 0.0 111.932 -177.426 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 14.4 tppt? -107.26 138.28 43.75 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 125.883 1.673 . . . . 0.0 109.063 164.649 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -49.57 114.32 1.02 Allowed 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.771 0.829 . . . . 0.0 110.872 175.173 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 107.52 -4.89 34.99 Favored Glycine 0 CA--C 1.534 1.238 0 C-N-CA 126.693 2.092 . . . . 0.0 114.677 -175.607 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 77.0 m-20 -70.0 120.46 15.75 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 119.734 1.767 . . . . 0.0 114.958 176.546 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 27.4 t -70.92 135.23 28.5 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 CA-C-N 118.539 0.609 . . . . 0.0 110.128 166.569 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 1.4 t -126.07 121.59 59.74 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.404 0 C-N-CA 125.547 1.539 . . . . 0.0 110.474 175.375 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 548' ' ' LEU . . . . . 0.498 HD23 ' HG2' ' A' ' 524' ' ' LYS . 30.6 mt -78.93 104.81 9.81 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 107.937 -1.135 . . . . 0.0 107.937 175.627 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 549' ' ' VAL . . . . . 0.463 HG21 ' CE1' ' A' ' 523' ' ' PHE . 30.9 t -61.03 131.71 26.14 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.901 0 CA-C-O 121.942 0.877 . . . . 0.0 113.17 170.743 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 5.6 pt -126.11 157.11 70.79 Favored Pre-proline 0 CA--C 1.542 0.672 0 C-N-CA 126.582 1.953 . . . . 0.0 108.504 175.936 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -66.62 145.89 77.51 Favored 'Trans proline' 0 N--CA 1.458 -0.595 0 C-N-CA 122.905 2.403 . . . . 0.0 110.74 176.147 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 32.8 m-85 . . . . . 0 C--O 1.234 0.28 0 N-CA-C 115.09 1.515 . . . . 0.0 115.09 177.912 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 35.6 tt0 . . . . . 0 CA--C 1.543 0.691 0 N-CA-C 113.37 0.878 . . . . 0.0 113.37 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 66.5 m-20 -95.13 146.6 24.19 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 127.945 2.498 . . . . 0.0 113.277 176.999 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -81.55 133.9 35.44 Favored 'General case' 0 N--CA 1.472 0.664 0 O-C-N 120.364 -1.46 . . . . 0.0 113.349 -173.843 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 76.9 -1.02 64.22 Favored Glycine 0 CA--C 1.538 1.522 0 C-N-CA 124.025 0.822 . . . . 0.0 114.282 -169.841 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 57.9 m95 -97.07 158.71 15.3 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 125.859 1.663 . . . . 0.0 112.056 174.989 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -135.03 156.47 48.98 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 126.993 2.117 . . . . 0.0 109.486 176.884 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 51.5 ttm -119.01 141.28 48.82 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 124.285 1.034 . . . . 0.0 112.004 175.646 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -171.06 -172.08 36.93 Favored Glycine 0 CA--C 1.524 0.625 0 C-N-CA 123.817 0.722 . . . . 0.0 113.267 179.773 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 12.7 p -133.47 139.94 47.89 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 C-N-CA 126.23 1.812 . . . . 0.0 109.189 173.087 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 34.9 mtmt -57.24 136.61 56.49 Favored 'General case' 0 N--CA 1.469 0.479 0 O-C-N 121.086 -1.009 . . . . 0.0 111.308 175.865 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -60.59 -39.43 88.08 Favored 'General case' 0 CA--C 1.539 0.552 0 O-C-N 122.012 -0.43 . . . . 0.0 110.714 174.914 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 34.2 t -71.13 -14.16 62.19 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 113.911 1.078 . . . . 0.0 113.911 176.073 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 72.5 m-20 -83.68 -45.22 13.66 Favored 'General case' 0 CA--C 1.541 0.626 0 O-C-N 120.709 -1.244 . . . . 0.0 113.848 166.465 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 61.4 t-105 -71.39 -37.76 71.55 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.952 1.301 . . . . 0.0 114.293 179.377 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 7.0 t-20 -67.17 -13.8 62.3 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 124.808 1.243 . . . . 0.0 112.027 174.858 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 5.2 mm-40 -91.48 1.58 57.03 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 125.333 1.453 . . . . 0.0 114.395 171.217 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 48.1 m-70 60.11 35.25 21.24 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 125.275 1.43 . . . . 0.0 112.935 177.84 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 26.6 mtpp -91.58 163.19 14.22 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 125.943 1.697 . . . . 0.0 111.983 -175.829 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 10.7 pm0 -56.37 99.6 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 125.37 1.468 . . . . 0.0 114.618 -170.243 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 54.8 tp -56.22 -46.04 79.66 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 124.186 0.994 . . . . 0.0 111.718 -173.631 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 -62.73 -14.44 44.51 Favored 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 115.095 1.517 . . . . 0.0 115.095 -178.847 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 33.8 mmtp -112.48 -35.88 5.42 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.752 1.221 . . . . 0.0 113.321 175.205 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 83.0 m -67.04 -24.12 65.96 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.163 0.985 . . . . 0.0 112.297 175.517 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 17.3 ptt180 -68.49 149.75 48.89 Favored 'General case' 0 N--CA 1.47 0.526 0 N-CA-C 113.348 0.869 . . . . 0.0 113.348 175.057 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -164.44 172.59 40.25 Favored Glycine 0 CA--C 1.528 0.875 0 CA-C-N 114.598 -1.183 . . . . 0.0 113.917 174.255 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 28.4 m -92.31 143.48 11.28 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 C-N-CA 124.906 1.282 . . . . 0.0 112.108 170.339 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 45.8 p90 -138.6 154.56 73.37 Favored Pre-proline 0 CA--C 1.546 0.789 0 C-N-CA 124.786 1.234 . . . . 0.0 113.949 176.282 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -65.78 113.85 2.71 Favored 'Trans proline' 0 C--N 1.35 0.618 0 C-N-CA 122.924 2.416 . . . . 0.0 110.291 169.672 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 20.1 pt-20 -60.08 -26.0 65.84 Favored 'General case' 0 N--CA 1.479 1.002 0 O-C-N 121.493 -0.754 . . . . 0.0 112.203 -175.136 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 11.2 p-10 -71.92 -18.49 62.02 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 126.969 2.108 . . . . 0.0 113.799 -179.576 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 19.7 m-85 -72.23 -12.19 61.06 Favored 'General case' 0 N--CA 1.467 0.395 0 N-CA-C 116.276 1.954 . . . . 0.0 116.276 166.496 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 589' ' ' THR . . . . . 0.519 HG22 ' HA ' ' A' ' 527' ' ' ALA . 69.5 p -128.25 168.39 15.55 Favored 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 125.536 1.534 . . . . 0.0 110.658 -174.354 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 16.3 pt-20 -122.35 137.15 54.95 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 124.124 0.97 . . . . 0.0 109.976 174.798 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 15.3 tpp85 -64.32 131.58 47.69 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 124.706 1.202 . . . . 0.0 109.94 177.619 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 592' ' ' VAL . . . . . 0.435 HG23 ' HB2' ' A' ' 524' ' ' LYS . 2.9 m . . . . . 0 N--CA 1.482 1.13 0 C-N-CA 125.645 1.578 . . . . 0.0 110.232 -177.545 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 98.9 Cg_endo . . . . . 0 CA--C 1.541 0.826 0 CA-C-O 121.67 0.613 . . . . 0.0 113.19 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 6.5 t -128.45 140.37 49.4 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.875 0 C-N-CA 126.153 1.781 . . . . 0.0 111.968 172.141 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -67.16 139.19 95.0 Favored Pre-proline 0 CA--C 1.55 0.965 0 O-C-N 121.518 -0.739 . . . . 0.0 112.835 -178.112 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -75.82 162.99 34.27 Favored 'Trans proline' 0 CA--C 1.543 0.967 0 C-N-CA 122.866 2.377 . . . . 0.0 113.204 -178.823 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 64.5 Cg_endo . . . . . 0 CA--C 1.539 0.772 0 C-N-CA 123.602 2.868 . . . . 0.0 112.408 179.661 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 517' ' ' LEU . . . . . 0.456 HD22 HD22 ' A' ' 548' ' ' LEU . 10.8 mt . . . . . 0 CA--C 1.542 0.642 0 N-CA-C 111.69 0.256 . . . . 0.0 111.69 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -68.25 159.09 54.74 Favored 'Trans proline' 0 CA--C 1.54 0.795 0 C-N-CA 123.302 2.668 . . . . 0.0 114.025 -172.737 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -61.61 129.96 29.84 Favored 'Trans proline' 0 N--CA 1.458 -0.607 0 C-N-CA 123.609 2.873 . . . . 0.0 110.998 178.856 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 75.79 1.11 66.0 Favored Glycine 0 CA--C 1.536 1.405 0 CA-C-O 117.294 -1.836 . . . . 0.0 115.893 -177.203 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 30.4 t80 -37.18 128.87 0.95 Allowed 'General case' 0 C--N 1.349 0.578 0 N-CA-C 117.155 2.28 . . . . 0.0 117.155 -179.405 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 56.1 mtm -100.01 -53.87 3.04 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 123.943 0.897 . . . . 0.0 113.025 -177.876 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 523' ' ' PHE . . . . . 0.4 ' CE2' HG21 ' A' ' 549' ' ' VAL . 29.1 p90 -165.93 170.67 13.46 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 126.497 1.919 . . . . 0.0 112.974 -174.159 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 524' ' ' LYS . . . . . 0.523 ' HE2' ' CD2' ' A' ' 548' ' ' LEU . 80.0 mttt -101.86 161.98 13.26 Favored 'General case' 0 N--CA 1.467 0.394 0 O-C-N 121.131 -0.981 . . . . 0.0 112.148 168.189 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 15.3 m -132.84 162.82 39.33 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 C-N-CA 126.471 1.909 . . . . 0.0 109.691 164.987 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 55.5 tt0 -127.12 130.62 50.18 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 118.827 0.739 . . . . 0.0 111.548 170.04 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 527' ' ' ALA . . . . . . . . . . . . . . . -59.53 130.9 49.15 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 123.693 0.797 . . . . 0.0 111.359 176.246 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 31.7 mm-40 -93.9 -25.79 17.16 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.372 1.469 . . . . 0.0 110.604 168.585 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 62.7 m-70 -132.55 164.86 25.69 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 127.03 2.132 . . . . 0.0 111.903 -176.691 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -85.07 132.27 34.34 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 106.504 -1.665 . . . . 0.0 106.504 175.891 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 90.0 t80 -120.62 109.99 15.9 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 124.071 0.948 . . . . 0.0 113.134 172.093 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 1.2 m -84.93 108.16 17.43 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 115.178 1.547 . . . . 0.0 115.178 173.638 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -64.25 144.38 57.19 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 125.951 1.7 . . . . 0.0 112.707 178.99 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 2.2 t -125.43 11.35 8.02 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 126.864 2.066 . . . . 0.0 115.44 -177.067 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 28.4 t0 -143.69 157.54 44.33 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 125.808 1.643 . . . . 0.0 107.619 177.595 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 3.2 t -69.93 -21.33 63.29 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 114.681 1.363 . . . . 0.0 114.681 165.036 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 22.9 m-20 -73.46 -19.96 60.82 Favored 'General case' 0 CA--C 1.541 0.635 0 N-CA-C 115.105 1.52 . . . . 0.0 115.105 169.497 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 73.5 mt-10 -87.13 142.34 27.99 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 125.774 1.63 . . . . 0.0 114.553 -177.425 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -88.41 131.76 34.73 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 126.717 2.007 . . . . 0.0 110.035 174.763 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -85.28 133.9 34.14 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 123.614 0.765 . . . . 0.0 110.797 172.344 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 77.0 mt -124.86 147.92 48.53 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.586 1.154 . . . . 0.0 111.957 175.574 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 7.8 tmtt? -115.47 142.98 45.99 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 126.179 1.792 . . . . 0.0 108.147 164.899 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -48.0 123.75 6.63 Favored 'General case' 0 CA--C 1.544 0.735 0 CA-C-N 119.167 0.894 . . . . 0.0 111.068 177.083 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 95.26 0.65 63.11 Favored Glycine 0 CA--C 1.534 1.245 0 C-N-CA 125.477 1.513 . . . . 0.0 114.526 -177.45 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 81.9 m-20 -72.59 119.25 16.55 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 119.249 1.525 . . . . 0.0 113.645 176.107 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 3.4 t -71.89 137.13 24.26 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.573 0 O-C-N 122.126 -0.359 . . . . 0.0 111.321 169.585 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 1.4 t -129.1 124.5 60.78 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.544 0 C-N-CA 125.625 1.57 . . . . 0.0 111.57 177.753 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 548' ' ' LEU . . . . . 0.523 ' CD2' ' HE2' ' A' ' 524' ' ' LYS . 16.7 mt -82.48 99.8 9.69 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.883 1.273 . . . . 0.0 108.581 176.756 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 549' ' ' VAL . . . . . 0.4 HG21 ' CE2' ' A' ' 523' ' ' PHE . 5.1 t -63.41 132.79 29.35 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.198 0 N-CA-C 114.692 1.367 . . . . 0.0 114.692 175.333 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 11.3 pt -129.22 156.55 78.15 Favored Pre-proline 0 CA--C 1.548 0.901 0 C-N-CA 127.09 2.156 . . . . 0.0 110.002 177.765 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -75.39 148.91 34.42 Favored 'Trans proline' 0 CA--C 1.534 0.513 0 C-N-CA 123.918 3.078 . . . . 0.0 112.058 175.678 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 552' ' ' PHE . . . . . 0.445 ' CE1' ' HA ' ' A' ' 558' ' ' GLN . 14.9 m-85 . . . . . 0 CA--C 1.538 0.5 0 N-CA-C 114.368 1.248 . . . . 0.0 114.368 179.163 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 558' ' ' GLN . . . . . 0.445 ' HA ' ' CE1' ' A' ' 552' ' ' PHE . 29.9 tt0 . . . . . 0 CA--C 1.534 0.343 0 CA-C-O 121.939 0.875 . . . . 0.0 112.276 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -142.31 144.41 33.23 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 125.83 1.652 . . . . 0.0 114.746 -179.702 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 39.0 tp10 -68.39 129.53 40.19 Favored 'General case' 0 CA--C 1.537 0.449 0 O-C-N 121.382 -0.824 . . . . 0.0 111.934 -176.526 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 83.31 -6.77 70.63 Favored Glycine 0 CA--C 1.537 1.428 0 C-N-CA 124.76 1.172 . . . . 0.0 114.436 -175.06 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 61.9 m95 -93.09 160.81 14.69 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 125.08 1.352 . . . . 0.0 112.688 174.63 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 14.0 mt -138.08 153.44 49.3 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 126.047 1.739 . . . . 0.0 109.332 168.712 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 54.4 ttm -109.69 143.51 39.37 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 124.184 0.993 . . . . 0.0 111.277 173.54 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -172.45 -171.84 37.68 Favored Glycine 0 CA--C 1.522 0.479 0 C-N-CA 123.699 0.666 . . . . 0.0 112.758 176.907 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 12.0 p -131.77 138.68 52.26 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.503 0 C-N-CA 125.03 1.332 . . . . 0.0 108.65 171.434 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 35.5 mtmt -59.18 136.71 58.04 Favored 'General case' 0 N--CA 1.467 0.404 0 O-C-N 121.272 -0.892 . . . . 0.0 110.759 178.119 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -59.19 -41.86 89.51 Favored 'General case' 0 C--O 1.219 -0.542 0 CA-C-O 117.906 -1.045 . . . . 0.0 110.37 175.654 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 38.0 t -62.39 -33.66 75.2 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 120.247 1.385 . . . . 0.0 112.467 176.781 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 77.8 m-20 -69.16 -43.9 73.37 Favored 'General case' 0 CA--C 1.542 0.666 0 N-CA-C 115.488 1.662 . . . . 0.0 115.488 173.402 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 65.7 t-105 -72.01 -31.62 66.39 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.606 1.562 . . . . 0.0 113.203 175.671 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 46.7 t-20 -76.32 -24.12 54.29 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 127.603 2.361 . . . . 0.0 111.893 172.085 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 81.2 mt-30 -80.8 -3.82 52.42 Favored 'General case' 0 CA--C 1.544 0.733 0 O-C-N 120.961 -1.087 . . . . 0.0 113.213 163.29 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 88.2 m-70 61.12 32.64 19.62 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 125.998 1.719 . . . . 0.0 113.755 171.769 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 74.3 mttt -70.03 160.48 31.89 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.711 1.604 . . . . 0.0 111.696 175.432 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 9.2 pm0 -56.29 111.59 1.01 Allowed 'General case' 0 CA--C 1.549 0.937 0 N-CA-C 113.383 0.882 . . . . 0.0 113.383 176.997 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 45.5 tp -57.54 -49.48 76.21 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 124.254 1.022 . . . . 0.0 112.872 -169.8 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 65.8 mm-40 -66.19 -16.51 64.05 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 113.828 1.047 . . . . 0.0 113.828 -174.378 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 18.3 tptm -97.34 -44.78 6.74 Favored 'General case' 0 N--CA 1.465 0.322 0 C-N-CA 125.249 1.42 . . . . 0.0 112.05 174.148 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 56.5 m -76.67 -17.09 59.33 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 114.927 1.454 . . . . 0.0 114.927 -177.153 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 7.9 ptt85 -63.33 160.12 16.61 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 123.807 0.843 . . . . 0.0 112.544 169.05 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -169.14 174.5 43.61 Favored Glycine 0 CA--C 1.526 0.775 0 CA-C-N 115.564 -0.744 . . . . 0.0 113.641 170.418 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 31.3 m -91.01 139.88 16.92 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.382 0 C-N-CA 124.706 1.203 . . . . 0.0 111.164 168.274 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 41.8 p90 -135.64 154.7 78.33 Favored Pre-proline 0 CA--C 1.539 0.55 0 C-N-CA 124.831 1.253 . . . . 0.0 112.152 174.808 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -68.38 114.44 3.46 Favored 'Trans proline' 0 CA--C 1.535 0.558 0 C-N-CA 122.103 1.869 . . . . 0.0 110.103 170.66 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 15.4 pt-20 -54.02 -30.63 48.35 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.835 0.854 . . . . 0.0 112.617 -179.22 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 7.3 p-10 -70.03 -18.08 63.28 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 127.041 2.137 . . . . 0.0 113.481 -177.432 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 19.6 m-85 -72.4 -11.08 60.53 Favored 'General case' 0 CA--C 1.536 0.409 0 N-CA-C 116.442 2.016 . . . . 0.0 116.442 163.507 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 589' ' ' THR . . . . . . . . . . . . . 34.2 p -125.29 178.42 5.6 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 126.331 1.852 . . . . 0.0 112.675 -175.902 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -131.43 140.1 49.54 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 125.458 1.503 . . . . 0.0 110.089 169.983 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -64.11 114.19 4.01 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 124.767 1.227 . . . . 0.0 109.855 171.68 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 592' ' ' VAL . . . . . 0.52 HG23 ' HB2' ' A' ' 524' ' ' LYS . 1.3 m . . . . . 0 N--CA 1.478 0.952 0 C-N-CA 125.308 1.443 . . . . 0.0 108.977 176.99 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo . . . . . 0 CA--C 1.54 0.799 0 CA-C-O 121.552 0.563 . . . . 0.0 112.95 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 3.5 t -134.62 131.71 54.09 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 C-N-CA 125.276 1.431 . . . . 0.0 112.443 -178.087 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -68.52 133.43 90.91 Favored Pre-proline 0 CA--C 1.548 0.897 0 O-C-N 121.443 -0.786 . . . . 0.0 111.491 -176.321 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -78.58 165.13 25.37 Favored 'Trans proline' 0 CA--C 1.548 1.186 0 C-N-CA 122.982 2.455 . . . . 0.0 113.088 -178.334 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo . . . . . 0 CA--C 1.539 0.735 0 C-N-CA 123.533 2.822 . . . . 0.0 114.028 179.263 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 517' ' ' LEU . . . . . 0.477 HD22 HD22 ' A' ' 548' ' ' LEU . 13.4 mt . . . . . 0 CA--C 1.538 0.517 0 CA-C-O 120.545 0.212 . . . . 0.0 110.526 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_endo -65.01 160.95 39.04 Favored 'Trans proline' 0 CA--C 1.538 0.695 0 C-N-CA 122.846 2.364 . . . . 0.0 113.484 -173.253 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -58.17 135.4 68.09 Favored 'Trans proline' 0 N--CA 1.46 -0.5 0 C-N-CA 122.893 2.396 . . . . 0.0 110.541 176.911 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 69.9 0.77 28.58 Favored Glycine 0 CA--C 1.535 1.308 0 CA-C-O 117.357 -1.802 . . . . 0.0 115.893 -178.677 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 34.7 t80 -36.29 125.28 0.79 Allowed 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 121.057 2.428 . . . . 0.0 116.814 -178.538 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 63.0 mtm -98.92 -53.31 3.31 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 123.344 0.658 . . . . 0.0 112.344 -177.15 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 523' ' ' PHE . . . . . . . . . . . . . 26.8 p90 -164.39 169.14 17.75 Favored 'General case' 0 C--O 1.223 -0.318 0 C-N-CA 126.332 1.853 . . . . 0.0 112.834 -174.093 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 524' ' ' LYS . . . . . 0.562 ' HE2' ' CD2' ' A' ' 548' ' ' LEU . 87.9 mttt -100.83 163.12 12.46 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 122.219 1.009 . . . . 0.0 111.253 166.938 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 17.3 m -135.45 161.6 38.9 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 C-N-CA 126.248 1.819 . . . . 0.0 109.016 165.92 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 58.0 tt0 -124.54 130.02 51.68 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 118.39 0.541 . . . . 0.0 111.877 169.848 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 527' ' ' ALA . . . . . 0.417 ' HA ' HG22 ' A' ' 589' ' ' THR . . . -59.59 124.13 19.1 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.988 0.915 . . . . 0.0 111.95 177.341 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 75.6 mm-40 -87.94 -25.74 23.05 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.127 1.371 . . . . 0.0 112.298 173.769 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 59.0 m-70 -139.2 167.81 21.24 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 127.177 2.191 . . . . 0.0 109.221 178.522 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 10.6 p-10 -85.22 138.81 32.11 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 125.071 1.348 . . . . 0.0 114.512 174.609 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 89.7 t80 -133.12 107.55 8.28 Favored 'General case' 0 C--O 1.235 0.299 0 C-N-CA 125.09 1.356 . . . . 0.0 111.803 179.198 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 532' ' ' THR . . . . . . . . . . . . 0.251 0.6 OUTLIER -81.61 104.55 12.1 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 113.697 0.999 . . . . 0.0 113.697 170.884 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -59.7 133.05 55.74 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 125.337 1.455 . . . . 0.0 110.895 176.986 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 4.4 t -109.1 -10.48 15.0 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.618 1.567 . . . . 0.0 115.047 -171.935 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 12.3 m-20 -133.45 153.36 51.68 Favored 'General case' 0 N--CA 1.463 0.209 0 C-N-CA 126.38 1.872 . . . . 0.0 115.745 176.929 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 536' ' ' THR . . . . . . . . . . . . 0.252 1.3 t -62.43 -27.42 69.1 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 116.582 2.067 . . . . 0.0 116.582 -171.301 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 87.2 m-20 -72.54 -17.49 61.72 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 116.407 2.002 . . . . 0.0 116.407 171.13 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 82.6 mt-10 -82.27 149.78 27.63 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.383 1.473 . . . . 0.0 114.243 -177.343 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -97.89 128.71 44.66 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 126.638 1.975 . . . . 0.0 110.422 177.651 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 15.3 tt0 -86.15 127.81 34.78 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 123.613 0.765 . . . . 0.0 111.549 178.495 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 76.9 mt -122.43 143.97 49.34 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 124.7 1.2 . . . . 0.0 112.295 -178.992 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 6.6 tmtm? -115.78 147.42 40.99 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 126.23 1.812 . . . . 0.0 109.329 169.717 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -54.12 120.49 6.52 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-O 121.993 0.901 . . . . 0.0 110.888 -179.613 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 100.47 0.79 55.56 Favored Glycine 0 CA--C 1.529 0.917 0 C-N-CA 125.381 1.467 . . . . 0.0 114.756 -178.481 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 80.8 m-20 -70.86 122.59 20.21 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 119.303 1.552 . . . . 0.0 113.77 -179.516 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 58.7 t -69.9 133.99 30.9 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.614 0 N-CA-C 109.198 -0.668 . . . . 0.0 109.198 166.93 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -126.69 124.16 64.47 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.503 0 C-N-CA 124.794 1.238 . . . . 0.0 111.41 171.757 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 548' ' ' LEU . . . . . 0.562 ' CD2' ' HE2' ' A' ' 524' ' ' LYS . 20.0 mt -80.13 100.07 8.06 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.547 1.139 . . . . 0.0 108.477 175.621 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 549' ' ' VAL . . . . . . . . . . . . . 4.1 t -63.51 132.0 29.23 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.224 0 N-CA-C 114.688 1.366 . . . . 0.0 114.688 173.837 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 17.0 pt -128.12 155.65 77.68 Favored Pre-proline 0 CA--C 1.544 0.739 0 C-N-CA 126.54 1.936 . . . . 0.0 110.435 179.186 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -70.52 152.77 65.6 Favored 'Trans proline' 0 N--CA 1.459 -0.53 0 C-N-CA 123.548 2.832 . . . . 0.0 110.619 171.329 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 52.2 m-85 . . . . . 0 C--N 1.329 -0.321 0 N-CA-C 115.792 1.775 . . . . 0.0 115.792 -176.706 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 40.1 tt0 . . . . . 0 N--CA 1.468 0.472 0 N-CA-C 113.669 0.989 . . . . 0.0 113.669 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 25.7 m-20 -127.43 149.65 49.99 Favored 'General case' 0 CA--C 1.553 1.079 0 C-N-CA 125.411 1.485 . . . . 0.0 110.8 -178.141 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -70.77 120.25 16.09 Favored 'General case' 0 N--CA 1.477 0.905 0 O-C-N 120.637 -1.289 . . . . 0.0 112.813 -170.331 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 83.68 -0.11 89.67 Favored Glycine 0 CA--C 1.54 1.636 0 C-N-CA 124.422 1.01 . . . . 0.0 115.275 -173.754 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 53.8 m95 -90.34 164.71 14.23 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 125.285 1.434 . . . . 0.0 113.437 176.102 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 11.4 mt -134.06 161.23 35.43 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 125.256 1.422 . . . . 0.0 110.517 165.657 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 55.8 ttm -116.01 145.91 42.58 Favored 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 124.853 1.261 . . . . 0.0 112.018 171.59 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -172.56 -169.44 35.2 Favored Glycine 0 CA--C 1.525 0.673 0 C-N-CA 124.402 1.001 . . . . 0.0 112.434 178.073 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 14.7 p -136.6 141.57 40.62 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 C-N-CA 125.731 1.612 . . . . 0.0 109.461 173.636 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 37.1 mtmt -58.07 135.22 56.96 Favored 'General case' 0 N--CA 1.469 0.518 0 O-C-N 121.138 -0.976 . . . . 0.0 110.788 174.967 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 19.5 tt0 -60.76 -39.0 87.16 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 119.636 -0.826 . . . . 0.0 110.186 174.273 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 47.3 t -58.09 -37.36 74.36 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 124.293 1.037 . . . . 0.0 112.427 177.15 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 -74.19 -44.28 54.01 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 114.959 1.466 . . . . 0.0 114.959 175.861 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 60.3 t-105 -67.67 -32.29 72.86 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.589 1.156 . . . . 0.0 112.975 176.562 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 26.7 t-20 -66.48 -35.66 80.83 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 126.414 1.886 . . . . 0.0 112.278 174.221 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 75.5 mt-30 -75.9 -5.7 47.36 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 125.566 1.546 . . . . 0.0 113.649 175.241 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 95.8 m-70 56.43 48.16 17.44 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 125.136 1.374 . . . . 0.0 112.66 -178.123 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 26.9 mttp -75.76 162.25 28.35 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 124.961 1.305 . . . . 0.0 111.778 166.533 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 14.1 pm0 -63.88 103.14 0.54 Allowed 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.379 1.072 . . . . 0.0 112.747 177.761 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 32.4 tp -58.31 -35.56 72.05 Favored 'General case' 0 CA--C 1.537 0.449 0 O-C-N 121.212 -0.93 . . . . 0.0 111.903 -174.515 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -65.08 -16.06 63.05 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 124.59 1.156 . . . . 0.0 113.885 -179.17 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 32.1 mmtp -114.28 -39.98 3.76 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 125.585 1.554 . . . . 0.0 112.442 177.623 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 39.1 m -70.51 -24.83 62.9 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 114.221 1.193 . . . . 0.0 114.221 177.063 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 17.3 ptp180 -62.01 160.97 11.46 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-N 118.91 0.777 . . . . 0.0 111.777 169.104 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -173.49 172.44 45.2 Favored Glycine 0 CA--C 1.521 0.468 0 CA-C-N 115.401 -0.818 . . . . 0.0 114.078 175.823 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 31.9 m -89.35 139.19 17.83 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.387 0 C-N-CA 124.282 1.033 . . . . 0.0 111.374 169.738 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 40.7 p90 -133.6 154.8 80.88 Favored Pre-proline 0 CA--C 1.541 0.628 0 C-N-CA 124.62 1.168 . . . . 0.0 112.889 173.381 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -65.61 110.75 1.7 Allowed 'Trans proline' 0 C--N 1.346 0.436 0 C-N-CA 122.039 1.826 . . . . 0.0 109.275 168.658 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 17.5 pt-20 -57.51 -26.93 62.07 Favored 'General case' 0 N--CA 1.474 0.744 0 O-C-N 121.506 -0.746 . . . . 0.0 112.32 -176.799 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 13.3 p-10 -71.51 -12.45 61.38 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 127.063 2.145 . . . . 0.0 114.64 178.278 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 18.4 m-85 -74.31 -13.74 60.8 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 116.862 2.171 . . . . 0.0 116.862 163.731 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 589' ' ' THR . . . . . 0.417 HG22 ' HA ' ' A' ' 527' ' ' ALA . 58.7 p -122.63 173.21 7.86 Favored 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 125.671 1.588 . . . . 0.0 111.893 -174.222 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -127.72 136.41 51.5 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 123.916 0.887 . . . . 0.0 109.691 171.731 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -64.33 120.09 11.55 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 125.567 1.547 . . . . 0.0 109.221 178.579 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 592' ' ' VAL . . . . . 0.524 HG23 ' HB2' ' A' ' 524' ' ' LYS . 2.3 m . . . . . 0 N--CA 1.476 0.86 0 C-N-CA 124.944 1.298 . . . . 0.0 108.329 177.539 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 88.9 Cg_endo . . . . . 0 CA--C 1.539 0.771 0 CA-C-O 121.343 0.476 . . . . 0.0 112.612 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 4.0 p -140.26 147.35 23.49 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 C-N-CA 125.958 1.703 . . . . 0.0 109.301 170.948 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -72.34 141.55 83.42 Favored Pre-proline 0 CA--C 1.554 1.101 0 N-CA-C 113.401 0.889 . . . . 0.0 113.401 -173.641 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -79.12 168.54 20.34 Favored 'Trans proline' 0 CA--C 1.552 1.396 0 C-N-CA 123.451 2.767 . . . . 0.0 113.378 178.061 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 35.9 Cg_exo . . . . . 0 CA--C 1.539 0.729 0 C-N-CA 124.217 3.278 . . . . 0.0 114.19 -179.694 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 517' ' ' LEU . . . . . 0.422 HD22 HD22 ' A' ' 548' ' ' LEU . 10.3 mt . . . . . 0 CA--C 1.55 0.973 0 CA-C-O 119.872 -0.109 . . . . 0.0 111.249 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -66.43 161.51 40.66 Favored 'Trans proline' 0 CA--C 1.538 0.709 0 C-N-CA 123.477 2.785 . . . . 0.0 114.287 -173.759 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -61.19 128.53 25.41 Favored 'Trans proline' 0 N--CA 1.459 -0.519 0 C-N-CA 123.244 2.63 . . . . 0.0 111.098 -179.4 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 73.03 6.84 69.22 Favored Glycine 0 CA--C 1.534 1.257 0 CA-C-O 117.453 -1.748 . . . . 0.0 116.238 -178.116 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 35.1 t80 -37.88 135.68 0.63 Allowed 'General case' 0 CA--C 1.547 0.865 0 CA-C-N 120.852 2.326 . . . . 0.0 117.134 -179.997 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 60.8 mtm -109.26 -51.5 2.87 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.448 0.699 . . . . 0.0 112.832 -179.099 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 523' ' ' PHE . . . . . . . . . . . . . 23.7 p90 -165.54 167.41 17.45 Favored 'General case' 0 C--O 1.223 -0.314 0 C-N-CA 125.984 1.713 . . . . 0.0 114.018 -174.018 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 524' ' ' LYS . . . . . 0.581 ' HB2' HG23 ' A' ' 592' ' ' VAL . 69.6 mttt -99.7 164.05 12.22 Favored 'General case' 0 N--CA 1.47 0.535 0 O-C-N 121.389 -0.819 . . . . 0.0 111.664 166.312 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 17.8 m -139.45 156.12 26.38 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.975 0 C-N-CA 126.952 2.101 . . . . 0.0 109.007 167.685 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 63.8 tt0 -119.01 128.88 54.79 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 119.157 0.889 . . . . 0.0 112.007 170.912 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 527' ' ' ALA . . . . . 0.459 ' HA ' HG22 ' A' ' 589' ' ' THR . . . -60.26 117.82 5.65 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.708 1.203 . . . . 0.0 111.726 176.434 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 65.4 mm-40 -81.44 -26.36 35.4 Favored 'General case' 0 CA--C 1.537 0.442 0 C-N-CA 124.741 1.217 . . . . 0.0 111.076 170.58 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 45.0 m80 -138.11 164.27 29.55 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 125.36 1.464 . . . . 0.0 112.476 -175.441 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . 0.253 1.7 p30 -77.41 132.33 38.45 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 115.015 1.487 . . . . 0.0 115.015 176.305 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 79.2 t80 -137.82 122.1 18.17 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 113.728 1.011 . . . . 0.0 113.728 176.707 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -87.44 125.14 34.11 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 114.665 1.357 . . . . 0.0 114.665 175.071 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -66.56 129.7 40.71 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-O 121.122 0.486 . . . . 0.0 110.851 169.561 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 4.6 p -97.9 -36.02 10.3 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 126.496 1.918 . . . . 0.0 113.777 171.436 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 96.4 m-20 -95.09 156.44 16.32 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 125.262 1.425 . . . . 0.0 114.642 176.197 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 7.7 t -54.99 -29.48 57.25 Favored 'General case' 0 N--CA 1.472 0.625 0 N-CA-C 114.665 1.357 . . . . 0.0 114.665 164.822 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 90.8 m-20 -104.97 6.13 33.26 Favored 'General case' 0 CA--C 1.544 0.726 0 N-CA-C 115.353 1.612 . . . . 0.0 115.353 175.867 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 57.3 mt-10 -86.19 152.11 23.09 Favored 'General case' 0 CA--C 1.541 0.621 0 O-C-N 120.392 -1.443 . . . . 0.0 111.103 165.0 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -101.87 132.92 47.37 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.92 1.288 . . . . 0.0 111.201 -176.294 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 29.1 tt0 -82.91 127.93 33.97 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 123.999 0.919 . . . . 0.0 109.941 174.354 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 85.0 mt -130.34 139.98 50.65 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 125.234 1.413 . . . . 0.0 111.696 -179.248 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 3.7 tmtt? -110.07 145.93 36.24 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 125.716 1.607 . . . . 0.0 110.048 168.085 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -54.54 96.06 0.01 OUTLIER 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 124.527 1.131 . . . . 0.0 112.085 173.113 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 134.01 -10.71 4.8 Favored Glycine 0 CA--C 1.536 1.377 0 C-N-CA 126.948 2.213 . . . . 0.0 114.717 -175.72 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 79.8 m-20 -77.88 127.35 32.25 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 114.962 1.467 . . . . 0.0 114.962 -170.272 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 1.9 t -77.27 135.94 25.45 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.827 0 N-CA-C 113.235 0.828 . . . . 0.0 113.235 167.899 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 1.4 t -124.59 121.91 62.55 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.358 0 C-N-CA 125.97 1.708 . . . . 0.0 110.996 175.843 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 548' ' ' LEU . . . . . 0.447 HD23 ' HG2' ' A' ' 524' ' ' LYS . 18.4 mt -77.22 101.98 6.45 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 108.212 -1.033 . . . . 0.0 108.212 172.202 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 549' ' ' VAL . . . . . . . . . . . . . 7.5 t -64.25 133.58 29.71 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.23 0 N-CA-C 114.548 1.314 . . . . 0.0 114.548 173.694 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 14.9 pt -130.2 159.27 71.2 Favored Pre-proline 0 CA--C 1.544 0.735 0 C-N-CA 126.728 2.011 . . . . 0.0 109.595 -178.348 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -71.1 141.72 40.47 Favored 'Trans proline' 0 C--O 1.24 0.62 0 C-N-CA 123.16 2.573 . . . . 0.0 111.83 175.848 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 45.4 m-85 . . . . . 0 C--O 1.236 0.345 0 N-CA-C 115.179 1.548 . . . . 0.0 115.179 166.455 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 40.7 tt0 . . . . . 0 CA--C 1.532 0.279 0 CA-C-O 121.781 0.801 . . . . 0.0 112.503 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 53.6 m-20 -85.31 142.3 29.44 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.884 1.274 . . . . 0.0 112.529 171.987 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 52.6 tp10 -78.36 131.81 37.14 Favored 'General case' 0 N--CA 1.469 0.512 0 O-C-N 120.292 -1.505 . . . . 0.0 111.368 -170.36 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 80.61 -4.05 71.0 Favored Glycine 0 CA--C 1.537 1.442 0 O-C-N 121.636 -0.665 . . . . 0.0 114.37 -173.133 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 47.5 m95 -89.75 165.27 14.27 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.21 1.404 . . . . 0.0 112.654 172.721 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 14.4 mt -134.87 154.82 51.5 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 125.545 1.538 . . . . 0.0 110.004 167.663 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 35.8 tpp -110.68 142.24 42.85 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 125.188 1.395 . . . . 0.0 110.863 171.651 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -165.07 -174.62 34.96 Favored Glycine 0 CA--C 1.526 0.744 0 O-C-N 121.336 -0.852 . . . . 0.0 113.561 174.922 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 13.0 p -130.62 139.71 50.58 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 C-N-CA 125.026 1.33 . . . . 0.0 108.8 169.341 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 36.3 mtmt -57.07 137.05 56.29 Favored 'General case' 0 N--CA 1.467 0.375 0 O-C-N 121.4 -0.813 . . . . 0.0 111.36 176.205 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 47.5 tt0 -60.96 -38.9 87.52 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-O 118.411 -0.804 . . . . 0.0 111.126 178.44 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 61.8 m -68.96 -31.91 71.12 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 119.504 1.047 . . . . 0.0 113.495 175.934 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 -65.57 -42.71 91.49 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 122.473 1.13 . . . . 0.0 113.924 170.057 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 46.9 t-105 -78.05 -27.58 48.75 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.668 1.187 . . . . 0.0 113.832 178.803 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 5.3 t-20 -67.04 -34.05 76.86 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 119.724 1.147 . . . . 0.0 110.98 173.922 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 39.3 mt-30 -73.83 -11.0 60.24 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 113.909 1.077 . . . . 0.0 113.909 165.492 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 68.7 m-70 56.68 38.44 29.54 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.434 1.494 . . . . 0.0 113.339 -178.252 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 62.5 mttt -60.82 162.82 6.31 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 125.221 1.409 . . . . 0.0 112.52 172.051 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -48.49 95.41 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 126.947 2.099 . . . . 0.0 113.867 174.786 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 49.9 tp -52.85 -47.8 67.52 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 125.801 1.64 . . . . 0.0 111.933 -169.744 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -63.33 -20.7 65.73 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 125.333 1.453 . . . . 0.0 114.601 -175.166 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 32.7 mmtp -102.73 -43.35 5.6 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.288 1.035 . . . . 0.0 111.756 176.218 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 62.1 m -63.22 -30.94 71.99 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 113.907 1.077 . . . . 0.0 113.907 176.48 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 2.7 ptt85 -62.57 166.1 5.65 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-O 122.32 1.057 . . . . 0.0 113.151 175.498 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -177.94 171.0 43.48 Favored Glycine 0 CA--C 1.524 0.646 0 CA-C-N 114.22 -1.355 . . . . 0.0 113.275 170.975 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 31.7 m -87.44 145.27 7.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 C-N-CA 124.983 1.313 . . . . 0.0 110.394 171.098 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 44.2 p90 -141.23 155.37 68.06 Favored Pre-proline 0 C--O 1.24 0.579 0 C-N-CA 124.115 0.966 . . . . 0.0 113.285 175.652 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -66.82 108.56 1.49 Allowed 'Trans proline' 0 N--CA 1.458 -0.561 0 C-N-CA 122.245 1.963 . . . . 0.0 109.489 169.515 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 17.7 pt-20 -55.5 -27.64 49.82 Favored 'General case' 0 N--CA 1.475 0.776 0 O-C-N 121.457 -0.777 . . . . 0.0 112.588 -177.533 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 11.5 p-10 -67.13 -21.66 65.82 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 125.967 1.707 . . . . 0.0 113.872 178.177 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 13.4 m-85 -68.53 -15.35 63.51 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 116.412 2.004 . . . . 0.0 116.412 166.407 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 589' ' ' THR . . . . . 0.459 HG22 ' HA ' ' A' ' 527' ' ' ALA . 62.7 p -120.62 174.85 6.31 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 126.065 1.746 . . . . 0.0 111.18 -177.473 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -135.64 139.77 44.02 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.886 0.874 . . . . 0.0 109.802 171.986 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -61.13 134.2 56.8 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 126.851 2.06 . . . . 0.0 112.157 -177.573 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 592' ' ' VAL . . . . . 0.581 HG23 ' HB2' ' A' ' 524' ' ' LYS . 3.5 m . . . . . 0 CA--C 1.546 0.806 0 C-N-CA 124.169 0.988 . . . . 0.0 109.854 177.295 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 78.9 Cg_endo . . . . . 0 CA--C 1.539 0.754 0 CA-C-O 122.064 0.777 . . . . 0.0 113.616 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 47.0 t -136.28 134.62 49.95 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.94 0 C-N-CA 126.294 1.837 . . . . 0.0 109.643 178.925 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -67.52 142.56 96.37 Favored Pre-proline 0 CA--C 1.551 0.991 0 N-CA-C 112.882 0.697 . . . . 0.0 112.882 -173.551 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -73.71 162.13 40.3 Favored 'Trans proline' 0 CA--C 1.539 0.731 0 C-N-CA 122.762 2.308 . . . . 0.0 111.861 176.385 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo . . . . . 0 CA--C 1.539 0.76 0 C-N-CA 122.812 2.341 . . . . 0.0 112.179 178.676 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 10.0 mt . . . . . 0 CA--C 1.544 0.718 0 N-CA-C 112.343 0.498 . . . . 0.0 112.343 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -66.91 160.39 47.2 Favored 'Trans proline' 0 CA--C 1.538 0.695 0 C-N-CA 123.755 2.97 . . . . 0.0 113.581 -173.774 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -63.99 135.67 48.84 Favored 'Trans proline' 0 N--CA 1.456 -0.732 0 C-N-CA 123.135 2.557 . . . . 0.0 109.787 178.997 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 70.6 1.57 38.29 Favored Glycine 0 CA--C 1.535 1.314 0 CA-C-O 116.693 -2.17 . . . . 0.0 116.306 -176.299 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 30.5 t80 -35.61 135.84 0.26 Allowed 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 117.573 2.434 . . . . 0.0 117.573 -178.631 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 44.9 mtm -103.99 -64.64 1.08 Allowed 'General case' 0 C--O 1.237 0.406 0 C-N-CA 123.271 0.628 . . . . 0.0 111.595 179.872 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 523' ' ' PHE . . . . . 0.437 ' CE2' HG21 ' A' ' 549' ' ' VAL . 41.6 p90 -158.78 174.55 14.85 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 124.781 1.232 . . . . 0.0 112.881 -175.39 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 524' ' ' LYS . . . . . 0.539 ' HE2' ' CD2' ' A' ' 548' ' ' LEU . 78.8 mttt -108.0 160.93 15.4 Favored 'General case' 0 N--CA 1.472 0.661 0 O-C-N 121.173 -0.954 . . . . 0.0 112.593 173.524 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 16.7 m -136.5 159.7 37.86 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 C-N-CA 126.698 1.999 . . . . 0.0 109.926 167.385 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 60.7 tt0 -122.55 130.88 53.5 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 124.031 0.932 . . . . 0.0 112.591 169.749 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 527' ' ' ALA . . . . . 0.424 ' HA ' HG22 ' A' ' 589' ' ' THR . . . -63.44 121.42 13.78 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.753 1.221 . . . . 0.0 112.613 178.289 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 60.6 mm-40 -84.32 -22.75 30.53 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.345 1.458 . . . . 0.0 111.986 172.974 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 52.7 m80 -142.72 161.88 36.93 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 126.418 1.887 . . . . 0.0 111.135 -168.672 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -87.8 123.39 32.54 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.981 1.712 . . . . 0.0 115.344 -179.729 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 78.2 t80 -130.56 113.45 14.25 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 124.33 1.052 . . . . 0.0 112.148 -176.241 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 1.2 m -89.33 127.07 35.76 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 124.636 1.175 . . . . 0.0 114.075 169.561 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -74.13 132.12 41.95 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-O 122.545 1.165 . . . . 0.0 112.778 -173.912 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 534' ' ' THR . . . . . . . . . . . . 0.289 3.3 t -108.97 14.88 23.82 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 126.214 1.806 . . . . 0.0 114.624 -177.928 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 24.9 t0 -150.7 159.34 44.58 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.86 1.264 . . . . 0.0 108.074 175.837 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 1.4 t -72.54 -10.43 59.78 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 115.01 1.485 . . . . 0.0 115.01 167.45 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 95.4 m-20 -76.64 -25.24 53.6 Favored 'General case' 0 N--CA 1.47 0.547 0 N-CA-C 116.379 1.992 . . . . 0.0 116.379 162.968 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 70.6 mt-10 -87.17 153.64 21.35 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 114.229 1.196 . . . . 0.0 114.229 -166.598 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -100.04 129.35 46.08 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 126.91 2.084 . . . . 0.0 110.051 176.549 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 18.4 tt0 -80.43 130.27 35.05 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.474 0.709 . . . . 0.0 110.198 173.183 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 78.2 mt -124.58 146.64 48.93 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 124.771 1.229 . . . . 0.0 111.067 176.721 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -116.77 149.21 40.3 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 124.474 1.11 . . . . 0.0 109.403 167.071 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -54.29 105.91 0.17 Allowed 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 123.233 0.613 . . . . 0.0 111.753 176.097 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 121.31 -8.64 10.32 Favored Glycine 0 CA--C 1.534 1.25 0 C-N-CA 126.678 2.085 . . . . 0.0 114.1 -177.826 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 84.6 m-20 -78.91 123.91 27.73 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 119.414 1.607 . . . . 0.0 114.757 -172.679 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 2.4 t -73.17 138.8 20.62 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 C-N-CA 123.74 0.816 . . . . 0.0 112.049 171.816 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -129.13 124.69 61.11 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.41 0 C-N-CA 125.192 1.397 . . . . 0.0 111.594 176.567 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 548' ' ' LEU . . . . . 0.539 ' CD2' ' HE2' ' A' ' 524' ' ' LYS . 17.3 mt -81.23 98.27 8.02 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.568 1.147 . . . . 0.0 108.134 176.252 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 549' ' ' VAL . . . . . 0.437 HG21 ' CE2' ' A' ' 523' ' ' PHE . 3.0 t -57.74 125.05 13.12 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.111 0 N-CA-C 113.548 0.944 . . . . 0.0 113.548 169.579 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 6.0 pt -122.76 157.53 59.51 Favored Pre-proline 0 N--CA 1.473 0.722 0 C-N-CA 126.641 1.976 . . . . 0.0 108.981 178.437 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -63.83 149.62 90.29 Favored 'Trans proline' 0 N--CA 1.461 -0.41 0 C-N-CA 122.635 2.223 . . . . 0.0 110.272 173.863 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 552' ' ' PHE . . . . . 0.426 ' CE1' ' HA ' ' A' ' 558' ' ' GLN . 29.3 m-85 . . . . . 0 C--N 1.33 -0.26 0 N-CA-C 116.188 1.921 . . . . 0.0 116.188 179.699 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 558' ' ' GLN . . . . . 0.426 ' HA ' ' CE1' ' A' ' 552' ' ' PHE . 40.6 tt0 . . . . . 0 C--O 1.236 0.387 0 N-CA-C 113.782 1.03 . . . . 0.0 113.782 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -125.93 144.26 50.76 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 125.005 1.322 . . . . 0.0 108.665 -170.954 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -77.64 129.9 36.16 Favored 'General case' 0 N--CA 1.475 0.782 0 O-C-N 120.205 -1.559 . . . . 0.0 112.666 -171.35 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 81.41 -0.42 87.84 Favored Glycine 0 CA--C 1.539 1.543 0 C-N-CA 124.37 0.986 . . . . 0.0 114.703 -172.967 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 54.0 m95 -102.59 162.69 12.73 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 126.789 2.036 . . . . 0.0 112.508 175.14 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 11.1 mt -138.74 154.86 48.57 Favored 'General case' 0 N--CA 1.472 0.655 0 O-C-N 121.146 -0.971 . . . . 0.0 110.894 172.864 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 48.3 ttm -112.79 139.88 48.04 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 124.983 1.313 . . . . 0.0 111.718 -179.164 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -170.08 -174.77 38.52 Favored Glycine 0 CA--C 1.522 0.528 0 C-N-CA 124.292 0.948 . . . . 0.0 112.732 178.264 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 13.8 p -128.24 140.29 49.6 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.493 0 C-N-CA 125.48 1.512 . . . . 0.0 109.118 170.416 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 36.3 mtmt -59.89 136.17 57.92 Favored 'General case' 0 N--CA 1.465 0.317 0 O-C-N 121.459 -0.775 . . . . 0.0 111.056 176.694 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -57.94 -40.55 80.78 Favored 'General case' 0 C--O 1.22 -0.453 0 CA-C-O 118.096 -0.954 . . . . 0.0 110.558 176.927 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 52.3 m -59.32 -44.05 92.63 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 119.903 1.228 . . . . 0.0 113.017 175.11 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -62.64 -35.2 78.85 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 115.336 1.606 . . . . 0.0 115.336 173.465 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 69.6 t-105 -79.54 -31.86 42.13 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.63 1.172 . . . . 0.0 113.332 175.476 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 21.8 t-20 -71.69 -30.23 65.45 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 126.332 1.853 . . . . 0.0 111.845 177.913 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 50.6 mt-30 -83.11 3.49 30.45 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 114.022 1.119 . . . . 0.0 114.022 171.127 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 55.3 m-70 57.93 30.18 18.74 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 126.316 1.846 . . . . 0.0 114.148 178.963 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 45.5 mttt -68.01 161.54 26.41 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 124.838 1.255 . . . . 0.0 111.351 174.296 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 20.0 pt-20 -56.4 105.92 0.24 Allowed 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 124.654 1.181 . . . . 0.0 114.122 -177.64 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 42.5 tp -54.39 -48.86 71.06 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 125.094 1.357 . . . . 0.0 112.14 -173.827 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 21.1 pm0 -59.05 -18.83 38.39 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 126.301 1.84 . . . . 0.0 114.974 -177.508 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 66.7 mmtt -124.74 -8.68 7.31 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 115.606 1.706 . . . . 0.0 115.606 177.403 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 97.9 m -80.16 -32.34 38.82 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 123.984 0.914 . . . . 0.0 112.27 163.422 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 36.4 ptt180 -61.61 157.12 18.17 Favored 'General case' 0 N--CA 1.474 0.733 0 O-C-N 121.378 -0.826 . . . . 0.0 112.724 174.944 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -170.2 174.86 44.3 Favored Glycine 0 CA--C 1.524 0.634 0 C-N-CA 124.643 1.116 . . . . 0.0 113.139 174.996 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 21.5 m -93.77 142.67 12.96 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 C-N-CA 124.553 1.141 . . . . 0.0 111.682 169.427 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 38.9 p90 -136.18 154.48 77.36 Favored Pre-proline 0 CA--C 1.539 0.525 0 C-N-CA 125.057 1.343 . . . . 0.0 112.863 176.699 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -66.21 112.85 2.43 Favored 'Trans proline' 0 N--CA 1.457 -0.65 0 C-N-CA 121.62 1.547 . . . . 0.0 108.845 169.57 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 22.1 pt-20 -52.73 -33.35 47.62 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 123.265 0.626 . . . . 0.0 111.821 -179.37 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 9.8 p-10 -69.99 -10.84 60.01 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 127.473 2.309 . . . . 0.0 114.636 -178.637 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 16.5 m-85 -77.24 -11.68 59.86 Favored 'General case' 0 N--CA 1.468 0.466 0 N-CA-C 116.82 2.155 . . . . 0.0 116.82 162.199 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 589' ' ' THR . . . . . 0.424 HG22 ' HA ' ' A' ' 527' ' ' ALA . 67.8 p -129.82 170.47 13.84 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 125.992 1.717 . . . . 0.0 111.779 -174.272 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -131.36 137.49 48.76 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 124.162 0.985 . . . . 0.0 110.74 175.985 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 12.9 tpt180 -56.98 135.12 56.21 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 126.366 1.866 . . . . 0.0 112.023 177.388 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 592' ' ' VAL . . . . . 0.52 HG23 ' HB2' ' A' ' 524' ' ' LYS . 2.1 m . . . . . 0 N--CA 1.481 1.084 0 C-N-CA 125.975 1.71 . . . . 0.0 109.304 176.13 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo . . . . . 0 CA--C 1.539 0.761 0 N-CA-C 114.459 0.907 . . . . 0.0 114.459 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 65.6 t -129.86 133.82 64.07 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.842 0 C-N-CA 126.268 1.827 . . . . 0.0 109.709 177.379 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -68.51 132.22 91.29 Favored Pre-proline 0 CA--C 1.549 0.912 0 O-C-N 121.651 -0.655 . . . . 0.0 111.887 179.764 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -75.78 167.0 27.19 Favored 'Trans proline' 0 CA--C 1.544 0.979 0 C-N-CA 122.134 1.889 . . . . 0.0 112.019 -177.503 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 73.8 Cg_exo . . . . . 0 C--N 1.347 0.5 0 C-N-CA 124.012 3.141 . . . . 0.0 112.654 169.931 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 517' ' ' LEU . . . . . 0.482 HD22 HD22 ' A' ' 548' ' ' LEU . 10.4 mt . . . . . 0 CA--C 1.537 0.475 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -65.52 158.22 54.17 Favored 'Trans proline' 0 CA--C 1.537 0.674 0 C-N-CA 123.882 3.055 . . . . 0.0 113.756 -169.482 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -62.2 133.42 43.61 Favored 'Trans proline' 0 N--CA 1.456 -0.733 0 C-N-CA 123.306 2.671 . . . . 0.0 109.809 177.705 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 75.13 3.17 68.52 Favored Glycine 0 CA--C 1.534 1.247 0 CA-C-O 117.73 -1.594 . . . . 0.0 115.432 -175.347 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 37.2 t80 -42.6 125.55 3.34 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 121.024 2.412 . . . . 0.0 116.21 178.951 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 60.5 mtm -97.06 -47.76 5.66 Favored 'General case' 0 N--CA 1.471 0.575 0 C-N-CA 123.782 0.833 . . . . 0.0 112.546 -177.195 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 523' ' ' PHE . . . . . 0.442 ' CE1' HG21 ' A' ' 549' ' ' VAL . 23.8 p90 -171.15 167.19 7.15 Favored 'General case' 0 C--O 1.223 -0.321 0 C-N-CA 128.177 2.591 . . . . 0.0 112.504 -176.404 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 524' ' ' LYS . . . . . 0.562 ' HG2' HD23 ' A' ' 548' ' ' LEU . 85.1 mttt -96.9 160.71 14.2 Favored 'General case' 0 N--CA 1.47 0.539 0 O-C-N 120.871 -1.143 . . . . 0.0 111.653 165.365 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 16.4 m -133.09 161.36 41.69 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 C-N-CA 125.334 1.453 . . . . 0.0 109.959 163.18 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 43.8 tt0 -128.33 128.92 45.49 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 124.009 0.923 . . . . 0.0 111.875 174.841 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 527' ' ' ALA . . . . . 0.545 ' HA ' HG22 ' A' ' 589' ' ' THR . . . -62.83 123.52 18.69 Favored 'General case' 0 CA--C 1.538 0.484 0 O-C-N 121.547 -0.721 . . . . 0.0 111.576 -178.584 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 42.3 mm-40 -87.24 -32.96 19.48 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 124.785 1.234 . . . . 0.0 110.044 168.888 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 97.6 m-70 -130.54 153.66 48.62 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 126.54 1.936 . . . . 0.0 110.798 179.039 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -79.42 141.6 36.69 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 125.276 1.43 . . . . 0.0 113.182 176.566 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 86.4 t80 -134.0 128.2 33.88 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 115.397 1.629 . . . . 0.0 115.397 -174.974 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -92.9 112.13 23.98 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 116.268 1.951 . . . . 0.0 116.268 177.983 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -67.7 130.69 43.78 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 123.835 0.854 . . . . 0.0 111.026 171.81 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 534' ' ' THR . . . . . . . . . . . . 0.259 12.1 t -136.39 31.23 2.89 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 125.946 1.698 . . . . 0.0 112.694 179.739 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 41.1 t0 -146.66 169.99 17.87 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 125.086 1.354 . . . . 0.0 109.056 167.364 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 1.1 t -67.6 -26.77 66.43 Favored 'General case' 0 N--CA 1.47 0.536 0 N-CA-C 115.871 1.804 . . . . 0.0 115.871 168.048 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 35.6 t0 -76.51 -27.71 56.13 Favored 'General case' 0 CA--C 1.547 0.852 0 O-C-N 121.069 -1.02 . . . . 0.0 110.887 178.363 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 60.3 mt-10 -80.76 149.29 29.71 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 115.404 1.631 . . . . 0.0 115.404 -164.596 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -101.62 137.88 39.35 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 128.967 2.907 . . . . 0.0 109.866 174.506 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 19.9 tt0 -95.47 134.95 37.73 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 123.994 0.917 . . . . 0.0 111.064 175.892 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 80.1 mt -125.68 148.1 49.13 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.388 1.075 . . . . 0.0 112.647 -178.189 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 3.1 tppp? -113.57 141.31 47.33 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 126.85 2.06 . . . . 0.0 109.497 164.491 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -52.47 114.02 1.24 Allowed 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 119.025 0.829 . . . . 0.0 110.982 173.575 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 115.61 -15.41 17.18 Favored Glycine 0 CA--C 1.529 0.936 0 C-N-CA 126.024 1.773 . . . . 0.0 113.463 -173.161 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 78.3 m-20 -66.83 118.63 10.61 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 118.953 1.377 . . . . 0.0 113.873 -178.037 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 45.9 t -72.53 134.75 29.22 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 166.791 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -127.49 123.08 60.82 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.386 0 C-N-CA 125.856 1.662 . . . . 0.0 111.184 175.86 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 548' ' ' LEU . . . . . 0.562 HD23 ' HG2' ' A' ' 524' ' ' LYS . 22.3 mt -81.39 98.84 8.39 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.894 1.278 . . . . 0.0 108.393 178.438 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 549' ' ' VAL . . . . . 0.442 HG21 ' CE1' ' A' ' 523' ' ' PHE . 3.4 t -62.43 131.97 27.98 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.236 0 N-CA-C 114.772 1.397 . . . . 0.0 114.772 175.812 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 18.2 pt -133.24 158.24 76.23 Favored Pre-proline 0 CA--C 1.551 1.011 0 C-N-CA 127.134 2.173 . . . . 0.0 109.935 177.859 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 82.8 Cg_endo -71.16 154.51 62.01 Favored 'Trans proline' 0 CA--C 1.537 0.626 0 C-N-CA 124.031 3.154 . . . . 0.0 112.016 174.639 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 24.5 m-85 . . . . . 0 CA--C 1.538 0.486 0 N-CA-C 116.747 2.129 . . . . 0.0 116.747 -174.728 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 42.7 tt0 . . . . . 0 N--CA 1.469 0.49 0 N-CA-C 113.053 0.76 . . . . 0.0 113.053 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 50.6 m-20 -90.84 128.65 36.81 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 126.012 1.725 . . . . 0.0 110.886 -179.246 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 6.0 tm-20 -65.04 135.1 55.19 Favored 'General case' 0 N--CA 1.475 0.814 0 O-C-N 120.358 -1.464 . . . . 0.0 111.608 -178.701 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 80.51 -5.72 63.42 Favored Glycine 0 CA--C 1.538 1.524 0 C-N-CA 124.25 0.928 . . . . 0.0 115.229 -174.651 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 48.0 m95 -93.95 167.15 11.79 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 125.199 1.4 . . . . 0.0 112.87 172.846 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 16.8 mt -134.36 160.15 38.83 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 124.49 1.116 . . . . 0.0 110.328 165.177 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 38.1 ttm -114.77 143.45 45.06 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 124.976 1.31 . . . . 0.0 111.307 175.503 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -170.58 -172.5 36.99 Favored Glycine 0 CA--C 1.523 0.586 0 CA-C-O 121.687 0.604 . . . . 0.0 113.304 176.288 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 14.5 p -132.54 136.91 55.29 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 C-N-CA 125.595 1.558 . . . . 0.0 109.214 173.226 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 40.4 mtmt -62.86 137.85 58.38 Favored 'General case' 0 N--CA 1.465 0.318 0 O-C-N 121.085 -1.009 . . . . 0.0 111.805 178.758 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 71.2 tt0 -58.04 -44.89 87.64 Favored 'General case' 0 C--O 1.222 -0.356 0 CA-C-O 118.268 -0.872 . . . . 0.0 110.866 -178.15 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 10.5 t -63.92 -26.5 68.62 Favored 'General case' 0 CA--C 1.546 0.79 0 CA-C-N 119.735 1.152 . . . . 0.0 112.983 -177.427 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -72.84 -48.23 39.49 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 126.69 1.996 . . . . 0.0 109.452 175.951 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 64.6 t-105 -67.64 -30.3 69.82 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.443 1.497 . . . . 0.0 113.003 176.154 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 33.8 t-20 -76.17 -25.68 55.48 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 127.009 2.124 . . . . 0.0 112.202 175.869 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 32.0 mt-30 -80.1 3.22 21.12 Favored 'General case' 0 CA--C 1.546 0.797 0 N-CA-C 113.375 0.88 . . . . 0.0 113.375 160.351 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 95.0 m-70 54.38 34.43 20.73 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 126.241 1.816 . . . . 0.0 114.491 175.697 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 5.6 mtpm? -75.05 158.17 33.61 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 125.289 1.436 . . . . 0.0 111.758 178.092 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 8.1 pm0 -53.18 108.83 0.36 Allowed 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.738 1.615 . . . . 0.0 114.37 -176.707 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 64.0 tp -57.0 -47.29 81.19 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 125.197 1.399 . . . . 0.0 112.945 -170.041 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 56.6 mt-10 -68.13 -24.07 64.97 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 114.488 1.292 . . . . 0.0 114.488 -174.852 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 43.1 mmtm -85.52 -47.05 10.27 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 123.618 0.767 . . . . 0.0 111.816 168.692 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 89.5 m -67.45 -28.53 67.96 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 114.381 1.252 . . . . 0.0 114.381 -172.13 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 36.2 ptt180 -64.63 163.27 14.07 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 124.635 1.174 . . . . 0.0 113.505 175.428 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -171.63 172.9 44.85 Favored Glycine 0 CA--C 1.531 1.057 0 C-N-CA 125.092 1.33 . . . . 0.0 114.27 174.449 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 14.7 m -91.67 143.97 10.2 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.61 0 C-N-CA 125.522 1.529 . . . . 0.0 112.639 170.847 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 49.3 p90 -142.25 155.59 64.69 Favored Pre-proline 0 CA--C 1.545 0.778 0 C-N-CA 124.876 1.27 . . . . 0.0 112.91 176.98 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_endo -69.08 110.3 2.38 Favored 'Trans proline' 0 C--N 1.348 0.548 0 C-N-CA 122.453 2.102 . . . . 0.0 109.973 171.651 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -57.3 -25.1 58.76 Favored 'General case' 0 N--CA 1.474 0.761 0 O-C-N 121.311 -0.868 . . . . 0.0 113.273 -179.364 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 8.7 p-10 -70.24 -9.51 56.1 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.33 1.452 . . . . 0.0 114.464 176.726 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 18.6 m-85 -80.22 -12.64 59.61 Favored 'General case' 0 CA--C 1.539 0.539 0 N-CA-C 116.668 2.099 . . . . 0.0 116.668 164.949 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 589' ' ' THR . . . . . 0.545 HG22 ' HA ' ' A' ' 527' ' ' ALA . 39.4 p -127.26 176.87 7.08 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 125.543 1.537 . . . . 0.0 110.591 -170.727 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 16.7 pt-20 -134.67 147.98 50.25 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 124.96 1.304 . . . . 0.0 110.747 173.085 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 2.7 tmm_? -60.21 136.85 58.15 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 124.631 1.173 . . . . 0.0 112.812 173.054 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 592' ' ' VAL . . . . . 0.476 HG23 ' CB ' ' A' ' 524' ' ' LYS . 1.1 m . . . . . 0 CA--C 1.549 0.909 0 C-N-CA 126.752 2.021 . . . . 0.0 109.302 177.099 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo . . . . . 0 CA--C 1.544 0.988 0 CA-C-O 122.034 0.764 . . . . 0.0 114.065 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 7.7 p -139.82 136.27 38.98 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 C-N-CA 125.3 1.44 . . . . 0.0 111.815 179.634 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -70.24 141.76 89.09 Favored Pre-proline 0 CA--C 1.553 1.081 0 O-C-N 121.496 -0.752 . . . . 0.0 112.915 -176.276 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -74.37 163.88 35.3 Favored 'Trans proline' 0 CA--C 1.543 0.93 0 C-N-CA 122.804 2.336 . . . . 0.0 111.947 174.329 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo . . . . . 0 CA--C 1.541 0.862 0 C-N-CA 122.581 2.187 . . . . 0.0 112.116 179.396 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 517' ' ' LEU . . . . . 0.472 HD22 HD22 ' A' ' 548' ' ' LEU . 18.0 mt . . . . . 0 CA--C 1.547 0.832 0 N-CA-C 113.731 1.012 . . . . 0.0 113.731 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 34.8 Cg_endo -67.3 161.07 44.72 Favored 'Trans proline' 0 CA--C 1.54 0.805 0 C-N-CA 124.296 3.331 . . . . 0.0 114.298 -173.72 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -63.87 128.26 21.54 Favored 'Trans proline' 0 C--N 1.35 0.616 0 C-N-CA 123.065 2.51 . . . . 0.0 110.414 -178.623 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 75.34 3.9 72.26 Favored Glycine 0 CA--C 1.534 1.221 0 CA-C-O 117.425 -1.764 . . . . 0.0 115.367 -177.246 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 31.7 t80 -36.17 132.19 0.56 Allowed 'General case' 0 CA--C 1.545 0.763 0 N-CA-C 117.387 2.366 . . . . 0.0 117.387 177.168 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 38.0 mtm -100.06 -56.55 2.34 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 123.848 0.859 . . . . 0.0 112.437 -177.195 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 523' ' ' PHE . . . . . . . . . . . . . 28.6 p90 -167.06 168.18 13.93 Favored 'General case' 0 C--O 1.225 -0.229 0 C-N-CA 127.44 2.296 . . . . 0.0 112.245 -172.279 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 524' ' ' LYS . . . . . 0.547 ' HB2' HG23 ' A' ' 592' ' ' VAL . 82.2 mttt -103.1 163.61 12.12 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 121.135 -0.978 . . . . 0.0 111.356 171.331 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 12.0 m -134.26 160.5 41.62 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.813 0 C-N-CA 126.889 2.076 . . . . 0.0 109.331 165.268 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 48.0 tt0 -124.06 128.26 49.07 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-N 119.618 1.099 . . . . 0.0 112.324 170.236 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 527' ' ' ALA . . . . . 0.479 ' HA ' HG22 ' A' ' 589' ' ' THR . . . -60.62 123.91 18.83 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 124.401 1.081 . . . . 0.0 111.105 178.049 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 76.5 mm-40 -85.39 -37.6 19.68 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 125.448 1.499 . . . . 0.0 111.104 171.103 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 81.3 m-70 -127.63 155.59 43.65 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 127.025 2.13 . . . . 0.0 109.438 176.624 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -82.19 151.29 26.96 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 107.41 -1.33 . . . . 0.0 107.41 178.387 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 94.1 t80 -137.88 113.82 9.89 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 125.099 1.36 . . . . 0.0 113.288 -178.609 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 2.0 m -86.36 118.89 26.09 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 124.405 1.082 . . . . 0.0 113.45 172.696 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -70.22 146.58 50.6 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 124.896 1.278 . . . . 0.0 113.077 -179.864 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 14.5 t -102.01 -31.78 10.48 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 125.314 1.446 . . . . 0.0 113.381 171.111 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 87.2 m-20 -108.08 155.32 20.52 Favored 'General case' 0 N--CA 1.47 0.544 0 N-CA-C 116.808 2.151 . . . . 0.0 116.808 -172.389 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 4.3 t -65.91 -13.3 59.43 Favored 'General case' 0 N--CA 1.483 1.198 0 N-CA-C 116.51 2.041 . . . . 0.0 116.51 -178.547 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . 0.298 63.6 m-20 -113.75 2.53 15.21 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 117.114 2.265 . . . . 0.0 117.114 167.6 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 53.0 mt-10 -74.22 142.84 45.34 Favored 'General case' 0 CA--C 1.541 0.619 0 O-C-N 120.253 -1.53 . . . . 0.0 111.412 167.09 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -89.62 130.98 35.84 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 126.133 1.773 . . . . 0.0 109.643 176.21 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 14.7 tt0 -85.19 131.25 34.46 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 121.677 -0.639 . . . . 0.0 111.422 173.054 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 75.0 mt -121.11 151.1 40.26 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 124.423 1.089 . . . . 0.0 112.631 179.004 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 6.8 tmtt? -116.85 140.57 49.29 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 126.322 1.849 . . . . 0.0 109.753 169.496 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -53.9 106.6 0.2 Allowed 'General case' 0 CA--C 1.548 0.875 0 CA-C-N 119.12 0.873 . . . . 0.0 110.968 175.515 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 114.63 -6.84 22.44 Favored Glycine 0 CA--C 1.538 1.48 0 C-N-CA 125.518 1.533 . . . . 0.0 114.743 -172.943 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -65.5 118.97 10.22 Favored 'General case' 0 CA--C 1.519 -0.227 0 CA-C-N 119.503 1.651 . . . . 0.0 113.723 174.613 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 2.8 t -70.63 134.52 29.9 Favored 'Isoleucine or valine' 0 C--O 1.236 0.352 0 C-N-CA 120.656 -0.418 . . . . 0.0 110.252 159.208 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 1.1 t -123.32 124.47 69.94 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 C-N-CA 125.612 1.565 . . . . 0.0 110.93 175.388 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 548' ' ' LEU . . . . . 0.472 HD22 HD22 ' A' ' 517' ' ' LEU . 22.2 mt -83.75 99.15 10.08 Favored 'General case' 0 C--N 1.324 -0.541 0 C-N-CA 124.56 1.144 . . . . 0.0 108.216 179.293 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 549' ' ' VAL . . . . . . . . . . . . . 4.1 t -61.57 129.56 24.66 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.109 0 N-CA-C 114.052 1.131 . . . . 0.0 114.052 174.545 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 10.5 pt -124.18 153.73 68.38 Favored Pre-proline 0 CA--C 1.548 0.874 0 C-N-CA 126.44 1.896 . . . . 0.0 110.723 178.233 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -71.17 135.46 27.17 Favored 'Trans proline' 0 CA--C 1.534 0.508 0 C-N-CA 123.91 3.074 . . . . 0.0 111.296 178.56 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 552' ' ' PHE . . . . . 0.443 ' CE1' ' HA ' ' A' ' 558' ' ' GLN . 23.9 m-85 . . . . . 0 CA--C 1.534 0.341 0 N-CA-C 117.664 2.468 . . . . 0.0 117.664 -174.963 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 558' ' ' GLN . . . . . 0.443 ' HA ' ' CE1' ' A' ' 552' ' ' PHE . 40.0 tp60 . . . . . 0 N--CA 1.47 0.529 0 CA-C-O 122.154 0.978 . . . . 0.0 111.853 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . 0.256 6.6 m-20 -141.16 150.66 43.05 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 126.485 1.914 . . . . 0.0 114.525 174.661 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 51.3 tp10 -75.23 127.5 33.33 Favored 'General case' 0 N--CA 1.472 0.64 0 O-C-N 121.013 -1.054 . . . . 0.0 111.06 -173.492 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 82.18 -7.26 64.33 Favored Glycine 0 CA--C 1.538 1.518 0 C-N-CA 124.484 1.04 . . . . 0.0 114.255 -168.874 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 60.8 m95 -98.41 155.57 17.17 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.851 1.261 . . . . 0.0 112.897 178.927 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 6.8 mt -143.55 152.49 41.5 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 125.201 1.401 . . . . 0.0 110.493 176.475 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 55.7 ttm -110.45 140.28 44.85 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 124.275 1.03 . . . . 0.0 112.359 -179.587 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -172.69 -171.69 37.71 Favored Glycine 0 CA--C 1.524 0.641 0 C-N-CA 123.92 0.772 . . . . 0.0 113.237 -179.284 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 11.6 p -131.87 143.2 40.94 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.53 0 C-N-CA 125.131 1.372 . . . . 0.0 110.506 172.375 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 42.0 mtmt -57.94 131.49 50.58 Favored 'General case' 0 N--CA 1.467 0.397 0 O-C-N 121.615 -0.678 . . . . 0.0 111.704 175.08 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -62.49 -40.59 97.19 Favored 'General case' 0 C--O 1.223 -0.325 0 CA-C-O 118.281 -0.866 . . . . 0.0 110.548 176.543 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 26.6 t -58.74 -32.33 69.13 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 119.559 1.072 . . . . 0.0 112.291 177.003 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -76.77 -45.72 27.94 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 114.98 1.474 . . . . 0.0 114.98 177.038 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 56.2 t-105 -67.28 -39.15 85.97 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.85 1.26 . . . . 0.0 112.957 176.492 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 5.0 t-20 -64.17 -28.71 69.94 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 124.894 1.278 . . . . 0.0 111.201 176.061 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 39.4 mt-30 -92.0 7.17 43.42 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.429 1.492 . . . . 0.0 114.614 171.991 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 89.0 m-70 56.48 34.74 24.83 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 126.432 1.893 . . . . 0.0 114.449 176.508 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 62.2 mttt -73.78 155.77 38.51 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.452 1.101 . . . . 0.0 111.614 174.553 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 12.8 pm0 -57.03 102.93 0.09 Allowed 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 115.403 1.631 . . . . 0.0 115.403 -170.413 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 47.5 tp -53.0 -45.91 68.09 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 125.097 1.359 . . . . 0.0 112.165 -176.697 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 19.5 pt-20 -63.21 -16.14 59.24 Favored 'General case' 0 N--CA 1.479 0.999 0 N-CA-C 115.202 1.556 . . . . 0.0 115.202 -176.889 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 29.0 tptp -114.57 -37.0 4.4 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 125.927 1.691 . . . . 0.0 112.345 -178.987 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 47.9 t -70.23 -30.57 67.67 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.217 1.407 . . . . 0.0 112.885 176.965 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 30.9 ptt85 -60.58 158.64 12.0 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 124.174 0.989 . . . . 0.0 112.839 176.701 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -179.25 175.91 47.47 Favored Glycine 0 N--CA 1.461 0.337 0 CA-C-N 115.966 -0.561 . . . . 0.0 114.375 173.111 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 34.7 m -88.52 140.19 16.19 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 C-N-CA 124.317 1.047 . . . . 0.0 111.149 167.719 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 43.3 p90 -134.44 155.25 79.88 Favored Pre-proline 0 CA--C 1.538 0.503 0 C-N-CA 125.159 1.383 . . . . 0.0 112.565 173.552 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -66.31 113.58 2.72 Favored 'Trans proline' 0 CA--C 1.536 0.617 0 C-N-CA 122.427 2.085 . . . . 0.0 110.451 171.307 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 15.6 pt-20 -60.28 -26.09 66.22 Favored 'General case' 0 N--CA 1.475 0.786 0 O-C-N 121.108 -0.995 . . . . 0.0 112.03 -178.01 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 13.8 p-10 -71.37 -9.21 57.78 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 126.99 2.116 . . . . 0.0 114.444 177.005 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 14.0 m-85 -81.16 -14.09 57.98 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 116.714 2.116 . . . . 0.0 116.714 163.446 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 589' ' ' THR . . . . . 0.479 HG22 ' HA ' ' A' ' 527' ' ' ALA . 54.7 p -126.61 168.85 13.75 Favored 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 125.106 1.362 . . . . 0.0 110.453 -172.766 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -120.66 141.65 50.18 Favored 'General case' 0 N--CA 1.465 0.289 0 C-N-CA 123.489 0.716 . . . . 0.0 109.857 173.912 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.06 130.13 42.24 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 124.412 1.085 . . . . 0.0 109.157 174.732 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 592' ' ' VAL . . . . . 0.547 HG23 ' HB2' ' A' ' 524' ' ' LYS . 4.7 m . . . . . 0 N--CA 1.477 0.92 0 C-N-CA 125.186 1.394 . . . . 0.0 108.938 179.446 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 92.9 Cg_endo . . . . . 0 CA--C 1.54 0.805 0 CA-C-O 121.368 0.487 . . . . 0.0 112.186 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 51.8 t -137.17 134.0 47.35 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 C-N-CA 125.461 1.504 . . . . 0.0 110.313 177.479 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -68.14 133.0 91.7 Favored Pre-proline 0 CA--C 1.547 0.849 0 CA-C-O 118.237 -0.887 . . . . 0.0 111.608 -175.23 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 3.2 Cg_exo -65.07 166.49 18.56 Favored 'Trans proline' 0 CA--C 1.541 0.839 0 C-N-CA 122.69 2.26 . . . . 0.0 113.221 -178.611 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 36.9 Cg_exo . . . . . 0 CA--C 1.54 0.778 0 C-N-CA 122.998 2.465 . . . . 0.0 112.364 162.688 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 517' ' ' LEU . . . . . 0.447 HD22 HD22 ' A' ' 548' ' ' LEU . 12.8 mt . . . . . 0 CA--C 1.544 0.732 0 N-CA-C 113.32 0.859 . . . . 0.0 113.32 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_endo -67.71 160.82 46.49 Favored 'Trans proline' 0 CA--C 1.543 0.97 0 C-N-CA 124.304 3.336 . . . . 0.0 114.622 -172.875 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 66.2 Cg_endo -64.07 133.53 38.77 Favored 'Trans proline' 0 C--N 1.349 0.558 0 C-N-CA 123.267 2.645 . . . . 0.0 110.488 177.56 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 73.8 0.61 55.99 Favored Glycine 0 CA--C 1.535 1.292 0 CA-C-O 117.36 -1.8 . . . . 0.0 115.386 -175.785 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 38.7 t80 -36.59 123.31 0.81 Allowed 'General case' 0 C--N 1.349 0.582 0 CA-C-N 120.717 2.258 . . . . 0.0 116.634 179.823 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 50.1 mtm -94.98 -54.2 3.54 Favored 'General case' 0 N--CA 1.465 0.316 0 C-N-CA 123.252 0.621 . . . . 0.0 111.28 -177.206 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 523' ' ' PHE . . . . . . . . . . . . . 24.9 p90 -167.96 167.16 12.93 Favored 'General case' 0 C--O 1.223 -0.314 0 C-N-CA 126.646 1.978 . . . . 0.0 113.085 -172.685 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 524' ' ' LYS . . . . . 0.583 ' HB2' HG23 ' A' ' 592' ' ' VAL . 80.6 mttt -100.26 161.74 13.41 Favored 'General case' 0 C--N 1.326 -0.433 0 O-C-N 121.3 -0.875 . . . . 0.0 111.039 167.616 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 18.0 m -136.86 154.88 32.27 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 C-N-CA 126.742 2.017 . . . . 0.0 108.794 167.833 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 44.6 tt0 -118.68 129.13 55.12 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 119.698 1.135 . . . . 0.0 111.261 173.063 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 527' ' ' ALA . . . . . 0.504 ' HA ' HG22 ' A' ' 589' ' ' THR . . . -62.72 119.32 9.06 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 124.028 0.931 . . . . 0.0 112.181 -178.444 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 44.7 mm-40 -85.79 -15.31 42.44 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 125.734 1.614 . . . . 0.0 111.932 173.958 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 92.3 m-70 -147.75 156.87 43.2 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 126.067 1.747 . . . . 0.0 111.369 -172.512 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -81.91 124.22 29.54 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 125.416 1.486 . . . . 0.0 114.646 175.957 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 88.4 t80 -129.87 114.56 16.04 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 124.68 1.192 . . . . 0.0 112.333 -177.426 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -83.04 125.63 31.67 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 124.341 1.056 . . . . 0.0 113.425 171.856 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -64.39 137.58 57.97 Favored 'General case' 0 CA--C 1.537 0.474 0 O-C-N 121.293 -0.879 . . . . 0.0 110.48 175.708 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 534' ' ' THR . . . . . . . . . . . . 0.272 2.0 t -132.35 3.53 3.94 Favored 'General case' 0 N--CA 1.473 0.722 0 N-CA-C 115.501 1.667 . . . . 0.0 115.501 -173.211 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -136.09 159.43 41.75 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 126.834 2.054 . . . . 0.0 115.1 165.509 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 1.2 t -61.76 -12.18 15.76 Favored 'General case' 0 N--CA 1.476 0.833 0 N-CA-C 117.143 2.275 . . . . 0.0 117.143 -172.563 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 17.5 p30 -111.91 -0.79 15.69 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 127.716 2.406 . . . . 0.0 116.366 177.866 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 76.7 mt-10 -81.47 144.11 31.59 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 114.437 1.273 . . . . 0.0 114.437 -175.634 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -84.86 152.23 23.73 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 125.825 1.65 . . . . 0.0 109.945 171.133 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -119.3 128.21 53.93 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 125.101 1.36 . . . . 0.0 110.541 -176.734 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 74.4 mt -128.07 146.72 50.6 Favored 'General case' 0 N--CA 1.471 0.575 0 C-N-CA 124.761 1.224 . . . . 0.0 112.25 -168.935 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -120.35 143.46 48.38 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 126.86 2.064 . . . . 0.0 109.404 173.232 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -55.77 99.69 0.03 OUTLIER 'General case' 0 CA--C 1.552 1.021 0 CA-C-N 119.619 1.099 . . . . 0.0 112.533 178.889 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 125.99 -7.22 7.73 Favored Glycine 0 CA--C 1.537 1.461 0 C-N-CA 126.545 2.021 . . . . 0.0 115.174 -173.728 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 80.4 m-20 -73.04 121.75 20.65 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-N 120.18 1.99 . . . . 0.0 114.223 -177.609 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 4.1 t -73.36 133.99 30.6 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 CA-C-N 119.386 0.994 . . . . 0.0 111.373 165.306 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 1.4 t -119.74 124.63 73.19 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.516 0 C-N-CA 126.173 1.789 . . . . 0.0 111.048 172.492 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 548' ' ' LEU . . . . . 0.451 ' CD2' ' HE2' ' A' ' 524' ' ' LYS . 22.5 mt -80.28 98.63 7.49 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 174.637 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 549' ' ' VAL . . . . . . . . . . . . . 4.1 t -62.95 130.4 27.52 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 N-CA-C 114.449 1.277 . . . . 0.0 114.449 174.283 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 20.9 pt -127.3 157.65 71.9 Favored Pre-proline 0 CA--C 1.546 0.805 0 C-N-CA 127.034 2.134 . . . . 0.0 109.838 177.73 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo -71.05 154.27 62.64 Favored 'Trans proline' 0 CA--C 1.54 0.789 0 C-N-CA 123.358 2.705 . . . . 0.0 112.431 174.565 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 43.5 m-85 . . . . . 0 CA--C 1.537 0.463 0 N-CA-C 116.855 2.168 . . . . 0.0 116.855 177.994 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 40.6 tt0 . . . . . 0 CA--C 1.544 0.738 0 N-CA-C 113.995 1.109 . . . . 0.0 113.995 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -85.49 131.28 34.4 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.175 1.39 . . . . 0.0 109.158 -177.867 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 73.6 tt0 -60.66 130.74 48.01 Favored 'General case' 0 N--CA 1.472 0.654 0 O-C-N 121.014 -1.054 . . . . 0.0 111.68 178.023 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 84.89 -12.02 58.45 Favored Glycine 0 CA--C 1.532 1.148 0 C-N-CA 124.833 1.206 . . . . 0.0 114.966 -178.7 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 48.6 m95 -91.48 155.48 18.39 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 124.664 1.186 . . . . 0.0 113.048 178.98 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 14.1 mt -126.76 151.94 47.54 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 124.038 0.935 . . . . 0.0 110.455 170.345 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 56.5 ttm -109.84 143.4 39.78 Favored 'General case' 0 N--CA 1.464 0.243 0 C-N-CA 124.179 0.992 . . . . 0.0 111.003 174.842 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -170.9 -172.9 37.61 Favored Glycine 0 CA--C 1.524 0.597 0 C-N-CA 123.888 0.756 . . . . 0.0 112.765 177.898 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 14.1 p -133.63 139.61 48.44 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.487 0 C-N-CA 125.232 1.413 . . . . 0.0 108.79 170.972 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 36.4 mtmt -58.49 136.68 57.58 Favored 'General case' 0 N--CA 1.467 0.418 0 O-C-N 121.215 -0.928 . . . . 0.0 111.16 175.71 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 19.6 tt0 -61.73 -40.74 96.17 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 118.281 -0.866 . . . . 0.0 110.876 179.436 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 34.3 m -61.38 -35.62 77.99 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 119.456 1.025 . . . . 0.0 112.663 176.48 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 67.1 m-20 -68.34 -46.62 69.66 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 125.742 1.617 . . . . 0.0 115.067 174.351 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 53.4 t-105 -66.94 -33.63 76.0 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 124.315 1.046 . . . . 0.0 112.242 174.532 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 4.2 t-20 -73.35 -23.7 60.25 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.273 1.429 . . . . 0.0 112.672 172.097 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 38.3 mt-30 -77.17 0.25 22.46 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 125.046 1.338 . . . . 0.0 113.399 168.279 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 91.9 m-70 62.18 31.71 17.55 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.442 1.497 . . . . 0.0 113.483 172.94 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 79.1 mttt -76.72 157.58 31.61 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 126.046 1.738 . . . . 0.0 112.083 177.176 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -62.23 113.47 2.9 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 124.348 1.059 . . . . 0.0 113.145 174.426 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 59.6 tp -56.32 -42.74 78.14 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.465 1.506 . . . . 0.0 112.046 -178.814 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 23.9 pt-20 -68.95 -8.36 43.79 Favored 'General case' 0 N--CA 1.477 0.88 0 N-CA-C 115.06 1.504 . . . . 0.0 115.06 -173.778 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 34.8 mmtp -111.72 -41.35 4.07 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 124.72 1.208 . . . . 0.0 111.778 166.78 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 96.6 m -76.49 -17.47 59.27 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 115.059 1.503 . . . . 0.0 115.059 -172.18 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 20.4 ptt180 -65.13 163.85 14.22 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 125.011 1.324 . . . . 0.0 112.629 169.279 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -167.11 174.18 42.36 Favored Glycine 0 CA--C 1.526 0.754 0 CA-C-N 114.734 -1.121 . . . . 0.0 113.985 169.542 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 31.5 m -93.55 140.83 15.74 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.594 0 C-N-CA 124.748 1.219 . . . . 0.0 110.705 168.333 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 40.9 p90 -138.02 156.54 74.03 Favored Pre-proline 0 CA--C 1.543 0.684 0 C-N-CA 124.274 1.03 . . . . 0.0 113.245 177.291 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -66.97 111.89 2.33 Favored 'Trans proline' 0 CA--C 1.535 0.571 0 C-N-CA 122.629 2.219 . . . . 0.0 110.169 170.015 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 22.1 pt-20 -56.22 -29.83 61.51 Favored 'General case' 0 N--CA 1.475 0.821 0 O-C-N 121.309 -0.87 . . . . 0.0 112.5 -178.72 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 13.0 p-10 -69.2 -14.14 62.8 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 127.019 2.127 . . . . 0.0 113.867 -179.587 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 18.8 m-85 -75.21 -8.86 57.78 Favored 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 116.952 2.205 . . . . 0.0 116.952 164.64 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 589' ' ' THR . . . . . 0.504 HG22 ' HA ' ' A' ' 527' ' ' ALA . 70.0 p -130.3 168.48 16.82 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 125.39 1.476 . . . . 0.0 111.827 -173.387 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -124.52 137.86 54.38 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 123.93 0.892 . . . . 0.0 109.791 173.422 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.93 137.85 56.36 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 124.712 1.205 . . . . 0.0 110.549 174.871 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 592' ' ' VAL . . . . . 0.583 HG23 ' HB2' ' A' ' 524' ' ' LYS . 2.7 m . . . . . 0 N--CA 1.48 1.029 0 C-N-CA 125.623 1.569 . . . . 0.0 109.601 178.322 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo . . . . . 0 CA--C 1.541 0.847 0 CA-C-O 122.173 0.822 . . . . 0.0 113.535 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 90.6 t -131.93 136.8 56.18 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.854 0 C-N-CA 126.559 1.944 . . . . 0.0 108.431 173.629 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -62.34 139.04 96.41 Favored Pre-proline 0 CA--C 1.547 0.864 0 O-C-N 121.78 -0.575 . . . . 0.0 111.952 -177.344 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -69.04 161.36 46.15 Favored 'Trans proline' 0 CA--C 1.539 0.738 0 C-N-CA 121.976 1.784 . . . . 0.0 110.587 177.995 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 46.9 Cg_exo . . . . . 0 N--CA 1.459 -0.51 0 C-N-CA 122.227 1.952 . . . . 0.0 111.95 176.194 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 517' ' ' LEU . . . . . 0.469 HD22 HD22 ' A' ' 548' ' ' LEU . 13.2 mt . . . . . 0 CA--C 1.543 0.676 0 N-CA-C 111.404 0.15 . . . . 0.0 111.404 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_endo -66.99 162.33 38.57 Favored 'Trans proline' 0 CA--C 1.538 0.718 0 C-N-CA 123.436 2.757 . . . . 0.0 114.776 -171.245 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -56.78 128.58 30.55 Favored 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 123.793 2.996 . . . . 0.0 111.077 176.536 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 73.9 2.26 61.04 Favored Glycine 0 CA--C 1.535 1.311 0 CA-C-O 116.956 -2.024 . . . . 0.0 116.384 -176.851 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 35.7 t80 -38.48 127.54 1.44 Allowed 'General case' 0 C--N 1.349 0.563 0 CA-C-N 121.053 2.427 . . . . 0.0 116.909 -175.741 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 48.8 mtm -104.25 -53.17 2.78 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 123.631 0.772 . . . . 0.0 112.116 -176.911 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 523' ' ' PHE . . . . . . . . . . . . . 25.6 p90 -166.58 172.29 10.86 Favored 'General case' 0 N--CA 1.465 0.322 0 C-N-CA 125.775 1.63 . . . . 0.0 113.181 -174.539 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 524' ' ' LYS . . . . . 0.542 ' HE2' ' CD2' ' A' ' 548' ' ' LEU . 78.3 mttt -104.52 164.8 11.49 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 121.214 -0.929 . . . . 0.0 112.446 170.369 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 14.6 m -133.85 161.92 40.22 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 126.686 1.995 . . . . 0.0 109.383 164.688 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 33.1 tt0 -125.44 130.01 50.98 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-N 118.929 0.786 . . . . 0.0 111.919 168.703 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 527' ' ' ALA . . . . . 0.475 ' HA ' HG22 ' A' ' 589' ' ' THR . . . -62.28 127.25 30.48 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.098 0.959 . . . . 0.0 111.518 178.613 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 40.1 mm-40 -88.66 -29.05 20.21 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 125.409 1.483 . . . . 0.0 110.813 170.634 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 97.5 m-70 -137.34 157.19 47.15 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 126.13 1.772 . . . . 0.0 111.518 -176.198 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 14.8 p-10 -83.12 131.6 35.13 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 114.908 1.447 . . . . 0.0 114.908 178.085 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 78.0 t80 -133.75 116.5 15.82 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.337 1.055 . . . . 0.0 112.356 -172.335 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 2.3 m -83.77 125.61 32.09 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 114.947 1.462 . . . . 0.0 114.947 176.657 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -71.67 142.49 49.88 Favored 'General case' 0 CA--C 1.538 0.508 0 O-C-N 121.459 -0.775 . . . . 0.0 111.702 172.634 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 2.9 t -138.44 -4.59 1.64 Allowed 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 126.476 1.91 . . . . 0.0 115.78 -175.845 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 19.6 m-20 -119.53 155.04 32.92 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 127.138 2.175 . . . . 0.0 116.018 164.082 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 5.6 t -55.75 -22.63 25.05 Favored 'General case' 0 N--CA 1.477 0.911 0 N-CA-C 116.62 2.081 . . . . 0.0 116.62 -179.628 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 70.1 m-20 -99.05 -8.14 25.75 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 115.622 1.712 . . . . 0.0 115.622 177.337 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 11.8 mt-10 -74.52 157.07 36.14 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 114.89 1.441 . . . . 0.0 114.89 -177.967 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -103.7 137.37 41.83 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 127.807 2.443 . . . . 0.0 111.147 173.808 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 33.4 tt0 -94.12 121.73 35.92 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.955 1.302 . . . . 0.0 111.512 176.443 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 71.2 mt -118.52 148.18 42.89 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.645 1.178 . . . . 0.0 113.076 -177.429 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 5.9 tppt? -112.25 145.04 40.65 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 127.245 2.218 . . . . 0.0 110.296 166.294 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -56.46 104.04 0.13 Allowed 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.694 0.798 . . . . 0.0 110.565 172.237 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 121.18 -9.45 10.24 Favored Glycine 0 CA--C 1.535 1.305 0 C-N-CA 125.925 1.726 . . . . 0.0 114.736 -173.183 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 88.7 m-20 -70.56 124.9 25.35 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 119.854 1.827 . . . . 0.0 114.945 -178.973 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 2.4 t -74.65 136.54 24.95 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 CA-C-N 118.313 0.506 . . . . 0.0 111.615 165.333 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 1.2 t -128.55 121.4 55.03 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 C-N-CA 124.69 1.196 . . . . 0.0 111.703 176.523 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 548' ' ' LEU . . . . . 0.542 ' CD2' ' HE2' ' A' ' 524' ' ' LYS . 17.2 mt -77.83 100.54 6.36 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.697 1.199 . . . . 0.0 108.533 175.792 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 549' ' ' VAL . . . . . . . . . . . . . 7.2 t -61.42 130.24 25.3 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.966 0 N-CA-C 113.945 1.091 . . . . 0.0 113.945 173.118 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 8.3 pt -127.61 156.76 74.91 Favored Pre-proline 0 CA--C 1.542 0.659 0 C-N-CA 126.443 1.897 . . . . 0.0 109.564 178.102 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 80.0 Cg_endo -70.78 154.19 63.85 Favored 'Trans proline' 0 CA--C 1.538 0.715 0 C-N-CA 123.016 2.477 . . . . 0.0 111.523 171.083 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 33.1 m-85 . . . . . 0 CA--C 1.542 0.649 0 N-CA-C 115.581 1.697 . . . . 0.0 115.581 172.02 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 38.4 tt0 . . . . . 0 CA--C 1.542 0.636 0 N-CA-C 113.184 0.809 . . . . 0.0 113.184 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -114.85 137.36 52.05 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 126.657 1.983 . . . . 0.0 113.757 -176.848 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 39.8 tp10 -74.39 133.95 42.45 Favored 'General case' 0 N--CA 1.474 0.744 0 O-C-N 120.406 -1.434 . . . . 0.0 112.664 -168.847 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 84.36 -8.1 69.43 Favored Glycine 0 CA--C 1.536 1.359 0 C-N-CA 125.412 1.482 . . . . 0.0 114.264 -173.4 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 60.2 m95 -92.58 161.41 14.6 Favored 'General case' 0 C--O 1.235 0.291 0 C-N-CA 125.389 1.476 . . . . 0.0 112.642 175.547 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 13.9 mt -132.99 152.15 51.99 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 124.815 1.246 . . . . 0.0 109.603 166.267 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 39.4 tpp -106.68 140.23 39.87 Favored 'General case' 0 N--CA 1.465 0.275 0 C-N-CA 124.46 1.104 . . . . 0.0 110.389 171.732 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -165.33 -172.72 33.1 Favored Glycine 0 CA--C 1.523 0.564 0 CA-C-O 122.191 0.884 . . . . 0.0 113.395 174.376 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 12.7 p -130.15 137.92 55.22 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.383 0 C-N-CA 125.386 1.474 . . . . 0.0 108.816 169.433 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 29.4 mtmt -56.82 134.19 54.99 Favored 'General case' 0 N--CA 1.465 0.303 0 O-C-N 121.406 -0.809 . . . . 0.0 110.917 175.49 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -61.41 -38.75 88.22 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-O 118.993 -0.527 . . . . 0.0 111.042 177.686 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 10.8 t -66.07 -35.0 79.36 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 119.439 1.018 . . . . 0.0 112.246 175.5 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 -59.15 -51.11 71.44 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 114.024 1.12 . . . . 0.0 114.024 168.53 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 61.9 t-105 -69.66 -32.54 71.24 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.685 1.594 . . . . 0.0 113.286 -178.817 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 12.3 t-20 -78.95 -18.38 53.86 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 125.315 1.446 . . . . 0.0 112.607 173.949 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 8.8 mm100 -90.08 5.26 47.49 Favored 'General case' 0 CA--C 1.546 0.822 0 CA-C-N 119.333 0.969 . . . . 0.0 113.514 163.509 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 83.8 m-70 61.85 25.81 15.56 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 126.367 1.867 . . . . 0.0 114.623 172.145 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 78.4 mttt -68.24 155.29 40.0 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 125.448 1.499 . . . . 0.0 111.489 177.28 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 6.9 pm0 -64.53 104.78 0.84 Allowed 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 114.295 1.22 . . . . 0.0 114.295 -169.133 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 56.1 tp -51.91 -45.06 64.09 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.348 1.059 . . . . 0.0 113.266 -173.961 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -66.28 -19.73 65.9 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 114.334 1.235 . . . . 0.0 114.334 -174.171 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 14.6 mmmm -100.37 -41.02 7.2 Favored 'General case' 0 N--CA 1.481 1.111 0 CA-C-N 119.104 0.865 . . . . 0.0 112.208 164.465 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 91.0 m -71.59 -23.61 61.76 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 114.979 1.474 . . . . 0.0 114.979 -169.733 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 38.0 ptt180 -62.38 166.03 5.47 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 125.097 1.359 . . . . 0.0 112.293 172.03 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -176.92 169.45 41.84 Favored Glycine 0 CA--C 1.522 0.509 0 N-CA-C 114.888 0.715 . . . . 0.0 114.888 172.583 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 31.6 m -86.06 145.71 7.42 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.213 0 C-N-CA 123.817 0.847 . . . . 0.0 110.872 170.909 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 47.8 p90 -142.96 155.07 62.62 Favored Pre-proline 0 CA--C 1.545 0.752 0 C-N-CA 125.426 1.49 . . . . 0.0 112.186 174.831 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -68.19 113.61 3.13 Favored 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.361 2.04 . . . . 0.0 109.703 171.441 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 20.2 pt-20 -58.6 -26.47 63.7 Favored 'General case' 0 N--CA 1.475 0.805 0 O-C-N 121.269 -0.894 . . . . 0.0 112.497 -177.668 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 9.0 p-10 -68.77 -16.2 63.73 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 126.503 1.921 . . . . 0.0 114.435 176.73 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 19.0 m-85 -72.78 -14.1 61.46 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 116.749 2.129 . . . . 0.0 116.749 162.008 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 589' ' ' THR . . . . . 0.475 HG22 ' HA ' ' A' ' 527' ' ' ALA . 64.1 p -124.27 177.27 5.94 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 126.173 1.789 . . . . 0.0 110.957 -176.261 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 16.8 pt-20 -131.62 138.57 48.85 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.511 0.724 . . . . 0.0 110.368 170.35 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -70.85 111.75 6.51 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 125.465 1.506 . . . . 0.0 109.849 -177.511 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 592' ' ' VAL . . . . . 0.471 HG23 ' HB2' ' A' ' 524' ' ' LYS . 2.6 m . . . . . 0 N--CA 1.479 1.014 0 C-N-CA 124.78 1.232 . . . . 0.0 109.428 -178.688 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 39.0 Cg_endo . . . . . 0 CA--C 1.536 0.585 0 N-CA-C 113.651 0.597 . . . . 0.0 113.651 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 19.9 t -132.64 125.36 52.85 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 125.337 1.455 . . . . 0.0 111.445 -178.324 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -66.04 141.11 97.33 Favored Pre-proline 0 CA--C 1.547 0.853 0 C-N-CA 123.639 0.776 . . . . 0.0 113.035 -174.443 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -72.7 167.17 27.88 Favored 'Trans proline' 0 CA--C 1.547 1.149 0 C-N-CA 122.415 2.076 . . . . 0.0 112.579 175.557 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo . . . . . 0 CA--C 1.536 0.608 0 C-N-CA 123.097 2.531 . . . . 0.0 113.244 174.495 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 513' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.963 0 N-CA-C 111.521 -0.632 . . . . 0.0 111.521 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 514' ' ' ARG . . . . . . . . . . . . . 10.1 mmt180 -102.42 151.71 21.97 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 125.832 1.653 . . . . 0.0 113.805 -174.422 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 39.3 tp -115.95 -18.31 10.73 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 124.548 1.139 . . . . 0.0 113.015 176.639 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 516' ' ' ASP . . . . . . . . . . . . 0.286 6.9 p-10 -80.25 118.41 21.89 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 123.878 0.871 . . . . 0.0 113.343 152.364 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 517' ' ' LEU . . . . . 0.492 HD22 HD22 ' A' ' 548' ' ' LEU . 14.1 mt -129.55 164.65 38.39 Favored Pre-proline 0 CA--C 1.543 0.703 0 C-N-CA 125.234 1.413 . . . . 0.0 112.23 -153.627 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -66.5 160.53 45.38 Favored 'Trans proline' 0 CA--C 1.537 0.631 0 C-N-CA 123.408 2.739 . . . . 0.0 113.401 -174.46 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 44.6 Cg_endo -59.05 133.15 51.43 Favored 'Trans proline' 0 N--CA 1.458 -0.564 0 C-N-CA 123.155 2.57 . . . . 0.0 110.656 -177.918 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 70.57 2.45 43.41 Favored Glycine 0 CA--C 1.537 1.451 0 CA-C-O 117.422 -1.765 . . . . 0.0 116.378 -178.803 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 19.6 t80 -34.6 131.61 0.34 Allowed 'General case' 0 CA--C 1.543 0.711 0 N-CA-C 117.76 2.504 . . . . 0.0 117.76 179.733 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 52.8 mtm -100.38 -57.02 2.21 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 -176.379 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 523' ' ' PHE . . . . . 0.481 ' CE1' HG21 ' A' ' 549' ' ' VAL . 32.7 p90 -167.58 173.7 8.38 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 127.963 2.505 . . . . 0.0 110.848 -176.093 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 524' ' ' LYS . . . . . 0.507 ' HE2' ' CD2' ' A' ' 548' ' ' LEU . 85.3 mttt -106.34 160.31 15.47 Favored 'General case' 0 N--CA 1.47 0.558 0 O-C-N 121.212 -0.93 . . . . 0.0 111.22 172.358 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 15.5 m -130.24 161.28 40.3 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 C-N-CA 126.184 1.794 . . . . 0.0 109.39 165.377 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 26.9 tt0 -127.41 128.83 46.46 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 119.541 1.064 . . . . 0.0 111.803 172.001 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 527' ' ' ALA . . . . . 0.407 ' HA ' HG22 ' A' ' 589' ' ' THR . . . -60.99 127.98 34.2 Favored 'General case' 0 CA--C 1.538 0.494 0 O-C-N 121.188 -0.945 . . . . 0.0 111.288 179.566 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 29.3 mm-40 -94.43 -25.75 16.78 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.49 1.516 . . . . 0.0 111.237 173.261 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 77.3 m-70 -135.66 162.9 31.43 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 127.444 2.298 . . . . 0.0 109.367 -178.652 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -90.51 143.31 26.87 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 121.117 -0.989 . . . . 0.0 113.29 177.958 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 89.6 t80 -136.25 125.29 24.37 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.978 1.311 . . . . 0.0 114.054 -177.982 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 3.5 m -96.92 120.64 37.64 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 113.785 1.032 . . . . 0.0 113.785 174.107 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -65.54 116.94 7.32 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-O 121.541 0.686 . . . . 0.0 111.901 -176.952 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 13.1 t -81.46 -28.54 34.11 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 123.897 0.879 . . . . 0.0 113.27 -173.82 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -140.36 176.72 8.54 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 116.268 1.951 . . . . 0.0 116.268 -165.343 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 536' ' ' THR . . . . . . . . . . . . 0.305 0.6 OUTLIER -75.84 -5.53 46.42 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 118.86 2.911 . . . . 0.0 118.86 -162.333 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . 0.389 1.6 p-10 -110.39 -10.22 14.59 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 115.832 1.79 . . . . 0.0 115.832 165.787 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 30.4 mp0 -80.4 145.2 32.11 Favored 'General case' 0 CA--C 1.557 1.238 0 N-CA-C 114.798 1.407 . . . . 0.0 114.798 -167.777 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -97.76 138.35 35.25 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 129.303 3.041 . . . . 0.0 110.699 -177.561 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 20.4 tt0 -90.49 135.0 33.97 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 123.958 0.903 . . . . 0.0 112.354 175.032 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 80.0 mt -126.75 145.75 50.49 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 125.159 1.384 . . . . 0.0 112.469 -179.691 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 9.9 tmtt? -112.32 141.2 46.33 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 125.34 1.456 . . . . 0.0 108.803 167.362 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -52.11 109.84 0.42 Allowed 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 118.888 0.767 . . . . 0.0 110.748 174.179 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 115.9 -8.81 18.91 Favored Glycine 0 CA--C 1.535 1.295 0 C-N-CA 125.797 1.665 . . . . 0.0 114.807 -174.651 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 64.5 m-20 -72.47 121.11 19.04 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 119.959 1.88 . . . . 0.0 114.279 -179.48 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 6.5 t -71.48 135.52 27.77 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 CA-C-N 118.688 0.676 . . . . 0.0 110.404 164.886 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -123.53 123.77 68.11 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.489 0 C-N-CA 125.813 1.645 . . . . 0.0 110.828 174.839 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 548' ' ' LEU . . . . . 0.507 ' CD2' ' HE2' ' A' ' 524' ' ' LYS . 21.6 mt -81.11 100.63 9.14 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 108.118 -1.067 . . . . 0.0 108.118 179.148 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 549' ' ' VAL . . . . . 0.481 HG21 ' CE1' ' A' ' 523' ' ' PHE . 5.7 t -60.43 130.02 23.72 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.166 0 N-CA-C 113.811 1.041 . . . . 0.0 113.811 174.31 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 10.2 pt -127.37 157.47 72.6 Favored Pre-proline 0 CA--C 1.549 0.936 0 C-N-CA 126.77 2.028 . . . . 0.0 110.514 177.263 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_endo -74.58 151.28 41.56 Favored 'Trans proline' 0 CA--C 1.54 0.812 0 C-N-CA 123.813 3.009 . . . . 0.0 111.729 172.402 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 552' ' ' PHE . . . . . 0.403 ' CE2' ' HA ' ' A' ' 558' ' ' GLN . 42.0 m-85 -69.04 155.7 39.91 Favored 'General case' 0 CA--C 1.539 0.523 0 N-CA-C 118.013 2.597 . . . . 0.0 118.013 -177.379 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 553' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 -75.67 -15.19 60.35 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 114.554 1.316 . . . . 0.0 114.554 171.413 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -159.38 152.16 18.04 Favored Pre-proline 0 CA--C 1.547 0.847 0 C-N-CA 125.861 1.664 . . . . 0.0 110.009 169.924 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 555' ' ' PRO . . . . . . . . . . . . . 91.7 Cg_endo -70.86 -29.52 18.53 Favored 'Trans proline' 0 CA--C 1.54 0.809 0 C-N-CA 123.736 2.957 . . . . 0.0 112.775 -179.794 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 26.4 pt-20 -70.89 -21.32 62.41 Favored 'General case' 0 CA--C 1.542 0.655 0 O-C-N 121.01 -1.056 . . . . 0.0 112.955 175.463 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 557' ' ' GLU . . . . . . . . . . . . . 40.8 mm-40 -79.6 -22.12 44.1 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.893 0.877 . . . . 0.0 113.1 179.165 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 558' ' ' GLN . . . . . 0.403 ' HA ' ' CE2' ' A' ' 552' ' ' PHE . 33.9 tt0 -69.72 103.64 2.2 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-O 122.731 1.253 . . . . 0.0 111.739 171.734 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . 0.254 48.7 m-20 -71.82 139.21 48.84 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 125.587 1.555 . . . . 0.0 114.427 174.395 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -70.18 124.6 24.52 Favored 'General case' 0 CA--C 1.541 0.629 0 O-C-N 120.754 -1.216 . . . . 0.0 110.944 -174.046 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 84.79 1.08 89.11 Favored Glycine 0 CA--C 1.54 1.595 0 N-CA-C 115.089 0.796 . . . . 0.0 115.089 -171.536 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 46.4 m95 -102.34 163.76 12.05 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 125.194 1.398 . . . . 0.0 113.554 179.564 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 14.5 mt -132.89 150.59 52.15 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 125.724 1.609 . . . . 0.0 109.856 170.155 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 54.8 ttm -106.12 140.57 38.88 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 124.208 1.003 . . . . 0.0 112.03 170.017 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -166.17 -172.57 33.66 Favored Glycine 0 CA--C 1.522 0.52 0 C-N-CA 124.37 0.986 . . . . 0.0 112.797 173.748 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 14.5 p -130.35 140.99 47.44 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.551 0 C-N-CA 125.405 1.482 . . . . 0.0 108.9 169.473 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 39.8 mtmt -58.6 136.24 57.56 Favored 'General case' 0 CA--C 1.52 -0.174 0 O-C-N 121.53 -0.731 . . . . 0.0 111.44 176.489 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -60.63 -40.89 93.59 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 117.663 -1.16 . . . . 0.0 111.783 -178.74 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 57.4 m -68.84 -35.59 77.14 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 120.52 1.509 . . . . 0.0 111.878 176.649 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -58.59 -33.11 69.62 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 114.05 1.129 . . . . 0.0 114.05 171.793 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 62.9 t-105 -84.77 -34.48 22.79 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.798 1.639 . . . . 0.0 113.888 174.709 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 7.8 t-20 -71.42 -22.0 61.91 Favored 'General case' 0 CA--C 1.552 1.023 0 C-N-CA 126.671 1.989 . . . . 0.0 111.984 175.006 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 41.4 mt-30 -85.55 -5.76 59.25 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 126.266 1.826 . . . . 0.0 113.04 167.083 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 21.7 m-70 58.49 38.38 25.53 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 127.392 2.277 . . . . 0.0 113.255 172.86 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 71.9 mttt -75.14 166.06 24.25 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 126.33 1.852 . . . . 0.0 112.476 177.99 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 3.2 pm0 -51.25 96.73 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 126.043 1.737 . . . . 0.0 114.644 177.685 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 42.8 tp -55.7 -49.32 73.32 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 126.057 1.743 . . . . 0.0 112.448 -170.079 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 64.0 mt-10 -67.73 -13.08 61.81 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 114.521 1.304 . . . . 0.0 114.521 -176.142 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 43.7 mmtm -105.18 -25.13 12.6 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 125.569 1.548 . . . . 0.0 112.898 172.466 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 90.3 m -82.61 -28.18 30.98 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 114.117 1.154 . . . . 0.0 114.117 178.109 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 36.4 ptt180 -70.24 161.65 29.91 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 124.454 1.102 . . . . 0.0 112.917 176.99 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -173.91 174.79 46.41 Favored Glycine 0 N--CA 1.468 0.812 0 C-N-CA 124.651 1.12 . . . . 0.0 114.493 176.526 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 13.1 m -93.27 137.33 22.77 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 C-N-CA 125.065 1.346 . . . . 0.0 112.7 172.033 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 39.8 p90 -132.33 155.68 80.99 Favored Pre-proline 0 CA--C 1.539 0.553 0 C-N-CA 125.098 1.359 . . . . 0.0 114.004 178.004 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 62.6 Cg_endo -66.75 107.82 1.34 Allowed 'Trans proline' 0 N--CA 1.458 -0.616 0 C-N-CA 122.49 2.127 . . . . 0.0 109.87 168.813 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 17.6 pt-20 -51.8 -30.06 21.66 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 124.558 1.143 . . . . 0.0 113.11 178.912 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 11.9 p-10 -70.67 -13.99 62.29 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 126.842 2.057 . . . . 0.0 114.33 179.437 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 9.9 m-85 -76.52 -14.62 60.01 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 116.384 1.994 . . . . 0.0 116.384 165.697 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 589' ' ' THR . . . . . 0.407 HG22 ' HA ' ' A' ' 527' ' ' ALA . 71.0 p -121.07 173.22 7.41 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 125.617 1.567 . . . . 0.0 111.871 -174.333 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -125.18 140.44 52.86 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 124.175 0.99 . . . . 0.0 110.195 171.417 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 15.4 tpt180 -62.97 114.74 3.86 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 124.682 1.193 . . . . 0.0 110.014 171.122 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 592' ' ' VAL . . . . . 0.44 HG23 ' HB2' ' A' ' 524' ' ' LYS . 2.0 m -96.2 154.47 38.77 Favored Pre-proline 0 N--CA 1.476 0.861 0 C-N-CA 124.521 1.128 . . . . 0.0 108.87 177.328 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 593' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo . . . . . 0 C--O 1.252 1.203 0 C-N-CA 124.292 3.328 . . . . 0.0 113.141 -177.297 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B 1728 ' ' SER . . . . . . . . . . . . . 9.3 p . . . . . 0 N--CA 1.477 0.919 0 N-CA-C 112.839 0.681 . . . . 0.0 112.839 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B 1729 ' ' THR . . . . . . . . . . . . 0.279 31.0 p 56.66 32.87 21.85 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 126.758 2.023 . . . . 0.0 115.374 163.724 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B 1730 ' ' VAL . . . . . . . . . . . . . 1.9 m -80.27 145.27 59.71 Favored Pre-proline 0 N--CA 1.48 1.06 0 N-CA-C 114.319 1.229 . . . . 0.0 114.319 176.634 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 79.7 Cg_endo -71.28 169.56 20.43 Favored 'Trans proline' 0 CA--C 1.542 0.91 0 C-N-CA 123.363 2.709 . . . . 0.0 113.185 172.964 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 11.8 t -132.12 128.27 58.87 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.12 0 C-N-CA 124.904 1.281 . . . . 0.0 112.71 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -67.21 136.63 93.85 Favored Pre-proline 0 CA--C 1.549 0.94 0 O-C-N 121.389 -0.82 . . . . 0.0 112.633 -176.896 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -77.41 162.28 30.92 Favored 'Trans proline' 0 CA--C 1.548 1.183 0 C-N-CA 123.032 2.488 . . . . 0.0 113.561 -175.559 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 61.8 Cg_endo -71.61 125.93 11.63 Favored 'Trans proline' 0 CA--C 1.54 0.794 0 C-N-CA 123.447 2.765 . . . . 0.0 112.909 -178.709 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B 1736 ' ' ARG . . . . . . . . . . . . . 1.9 mpp_? -77.78 155.46 31.13 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 125.218 1.407 . . . . 0.0 111.128 172.799 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B 1737 ' ' ARG . . . . . . . . . . . . . 11.9 mmt85 -120.09 160.52 22.69 Favored 'General case' 0 N--CA 1.479 1.008 0 N-CA-C 112.912 0.708 . . . . 0.0 112.912 -165.041 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B 1738 ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -57.33 143.93 37.91 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 123.81 0.844 . . . . 0.0 112.399 178.57 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B 1739 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -153.07 154.37 34.74 Favored 'General case' 0 N--CA 1.479 1.019 0 N-CA-C 113.288 0.848 . . . . 0.0 113.288 164.018 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B 1740 ' ' GLY . . . . . . . . . . . . . . . 65.28 24.76 70.81 Favored Glycine 0 CA--C 1.537 1.463 0 C-N-CA 124.283 0.944 . . . . 0.0 115.03 179.541 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B 1741 ' ' ARG . . . . . . . . . . . . . 64.8 ttt-85 -74.03 129.98 38.94 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 124.974 1.31 . . . . 0.0 112.033 -173.505 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B 1742 ' ' ASN . . . . . . . . . . . . . 2.0 t30 -155.83 138.18 14.83 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.943 1.297 . . . . 0.0 111.9 -177.137 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B 1743 ' ' LEU . . . . . . . . . . . . . 94.8 mt -140.6 163.15 33.64 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 126.299 1.839 . . . . 0.0 110.753 176.424 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B 1744 ' ' THR . . . . . . . . . . . . 0.278 0.2 OUTLIER . . . . . 0 C--O 1.257 1.472 0 N-CA-C 117.378 2.362 . . . . 0.0 117.378 -178.745 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 513' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.773 0 N-CA-C 111.427 -0.669 . . . . 0.0 111.427 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 514' ' ' ARG . . . . . . . . . . . . . 17.7 mmt180 -138.09 153.8 49.27 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 126.66 1.984 . . . . 0.0 112.74 176.508 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 49.2 tp -120.91 -20.4 6.92 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.551 1.541 . . . . 0.0 113.255 174.079 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 516' ' ' ASP . . . . . . . . . . . . 0.322 2.3 p-10 -66.9 112.23 4.19 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 119.353 0.979 . . . . 0.0 112.475 148.866 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 517' ' ' LEU . . . . . 0.48 HD22 HD22 ' A' ' 548' ' ' LEU . 12.1 mt -127.96 160.36 61.8 Favored Pre-proline 0 CA--C 1.537 0.469 0 C-N-CA 124.86 1.264 . . . . 0.0 111.213 -161.325 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -64.47 159.48 44.09 Favored 'Trans proline' 0 N--CA 1.458 -0.591 0 C-N-CA 122.986 2.457 . . . . 0.0 112.94 -174.178 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -62.5 135.58 54.06 Favored 'Trans proline' 0 N--CA 1.457 -0.662 0 C-N-CA 122.503 2.135 . . . . 0.0 109.89 177.318 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 77.57 -3.69 58.76 Favored Glycine 0 CA--C 1.531 1.06 0 CA-C-O 117.358 -1.801 . . . . 0.0 115.217 -179.762 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 32.8 t80 -34.64 125.05 0.53 Allowed 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 117.202 2.297 . . . . 0.0 117.202 -176.781 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 45.7 mtm -94.45 -51.43 4.77 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 112.241 0.46 . . . . 0.0 112.241 -178.019 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 523' ' ' PHE . . . . . . . . . . . . . 22.6 p90 -171.0 167.12 7.35 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 127.645 2.378 . . . . 0.0 112.609 -172.072 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 524' ' ' LYS . . . . . 0.473 ' HB2' HG23 ' A' ' 592' ' ' VAL . 72.1 mttt -96.81 160.27 14.46 Favored 'General case' 0 CA--C 1.534 0.332 0 O-C-N 121.234 -0.916 . . . . 0.0 111.027 166.699 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 32.1 m -134.56 158.49 41.77 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 C-N-CA 126.297 1.839 . . . . 0.0 108.614 166.889 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 40.1 tt0 -125.43 130.16 51.29 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-N 119.327 0.967 . . . . 0.0 112.343 173.989 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 527' ' ' ALA . . . . . 0.558 ' HA ' HG22 ' A' ' 589' ' ' THR . . . -64.98 117.9 8.3 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 124.488 1.115 . . . . 0.0 111.426 -177.669 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 75.7 mm-40 -80.87 -29.13 35.8 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 123.474 0.709 . . . . 0.0 111.459 173.497 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 97.8 m-70 -136.83 160.11 39.84 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 125.894 1.678 . . . . 0.0 111.295 -177.928 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . 0.312 4.6 p30 -82.33 136.36 35.03 Favored 'General case' 0 CA--C 1.546 0.807 0 N-CA-C 115.651 1.723 . . . . 0.0 115.651 178.817 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 82.3 t80 -140.26 128.75 22.78 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 126.095 1.758 . . . . 0.0 112.955 -178.551 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 2.6 m -104.17 135.77 45.03 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 124.864 1.266 . . . . 0.0 113.985 175.501 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -73.23 126.77 30.85 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 112.85 0.685 . . . . 0.0 112.85 -173.452 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 2.8 p -90.96 -3.66 57.12 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 127.757 2.423 . . . . 0.0 116.051 177.669 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 24.6 t0 -148.97 159.47 44.17 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.383 1.473 . . . . 0.0 107.878 -170.225 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 2.0 t -67.24 -20.86 65.73 Favored 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 115.048 1.499 . . . . 0.0 115.048 169.448 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 13.8 t0 -82.53 -20.36 36.8 Favored 'General case' 0 CA--C 1.551 0.986 0 C-N-CA 123.349 0.66 . . . . 0.0 110.426 177.562 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 72.1 mt-10 -82.13 153.12 26.2 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 125.252 1.421 . . . . 0.0 114.744 -173.867 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -98.54 139.1 34.78 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 127.684 2.393 . . . . 0.0 110.307 176.668 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 14.3 tt0 -91.38 130.88 37.17 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.001 0.92 . . . . 0.0 111.07 172.233 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 73.4 mt -128.61 139.96 52.01 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 124.939 1.296 . . . . 0.0 112.245 -177.535 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 14.3 tmtt? -110.55 145.7 37.33 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 126.257 1.823 . . . . 0.0 109.872 171.177 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -59.21 94.24 0.02 OUTLIER 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 124.231 1.013 . . . . 0.0 112.5 177.675 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 131.45 -8.81 5.6 Favored Glycine 0 CA--C 1.532 1.099 0 C-N-CA 126.522 2.01 . . . . 0.0 114.758 -173.399 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 86.2 m-20 -70.7 122.22 19.41 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 119.766 1.783 . . . . 0.0 114.248 -178.547 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 3.4 t -72.2 135.96 26.71 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.415 0 CA-C-N 118.378 0.535 . . . . 0.0 110.546 163.281 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 1.3 t -125.1 123.78 66.1 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.453 0 C-N-CA 126.749 2.02 . . . . 0.0 110.607 177.052 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 548' ' ' LEU . . . . . 0.48 HD22 HD22 ' A' ' 517' ' ' LEU . 26.7 mt -81.38 98.69 8.32 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 108.15 -1.056 . . . . 0.0 108.15 177.752 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 549' ' ' VAL . . . . . . . . . . . . . 5.9 t -62.93 132.05 28.62 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.132 0 N-CA-C 114.315 1.228 . . . . 0.0 114.315 175.277 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 15.0 pt -126.63 154.72 75.53 Favored Pre-proline 0 CA--C 1.546 0.807 0 C-N-CA 126.502 1.921 . . . . 0.0 110.395 176.865 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 89.4 Cg_endo -75.69 142.37 25.76 Favored 'Trans proline' 0 C--O 1.241 0.645 0 C-N-CA 123.901 3.067 . . . . 0.0 111.807 177.465 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 48.4 m-85 -60.73 149.56 35.13 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 115.552 1.686 . . . . 0.0 115.552 178.757 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 553' ' ' GLN . . . . . 0.57 ' CD ' ' H ' ' A' ' 553' ' ' GLN . 0.0 OUTLIER -67.6 -29.42 68.76 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 124.993 1.317 . . . . 0.0 113.227 174.874 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 8.4 m-20 -150.54 149.81 27.11 Favored Pre-proline 0 CA--C 1.539 0.556 0 C-N-CA 125.019 1.327 . . . . 0.0 112.186 169.85 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 555' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -67.1 -37.73 17.96 Favored 'Trans proline' 0 CA--C 1.537 0.651 0 C-N-CA 123.123 2.549 . . . . 0.0 111.957 174.112 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 24.0 pt-20 -68.76 -11.72 60.65 Favored 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 114.024 1.12 . . . . 0.0 114.024 176.013 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 557' ' ' GLU . . . . . . . . . . . . . 72.3 mm-40 -90.32 -27.27 19.52 Favored 'General case' 0 CA--C 1.539 0.55 0 O-C-N 121.292 -0.88 . . . . 0.0 112.764 173.471 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 48.2 tt0 -66.7 125.25 25.22 Favored 'General case' 0 C--O 1.236 0.346 0 C-N-CA 125.055 1.342 . . . . 0.0 112.388 179.473 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 56.2 m-20 -82.67 141.81 32.18 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 125.262 1.425 . . . . 0.0 109.324 175.991 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 87.4 tt0 -76.94 125.94 30.15 Favored 'General case' 0 N--CA 1.471 0.59 0 O-C-N 120.633 -1.292 . . . . 0.0 110.543 -176.181 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 84.64 7.81 83.84 Favored Glycine 0 CA--C 1.537 1.466 0 CA-C-O 118.869 -0.962 . . . . 0.0 114.978 -171.889 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 43.3 m95 -111.7 155.97 22.62 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 125.709 1.603 . . . . 0.0 114.016 -179.6 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 12.6 mt -123.96 159.3 30.07 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.384 1.073 . . . . 0.0 110.725 172.098 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 51.9 ttm -118.32 143.25 46.75 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 125.051 1.341 . . . . 0.0 111.383 173.004 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -173.56 -167.54 33.43 Favored Glycine 0 CA--C 1.525 0.707 0 C-N-CA 124.256 0.931 . . . . 0.0 112.741 178.277 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 14.7 p -136.03 142.02 40.06 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 C-N-CA 125.378 1.471 . . . . 0.0 109.342 172.738 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 36.4 mtmt -58.1 135.09 56.96 Favored 'General case' 0 N--CA 1.468 0.475 0 O-C-N 121.338 -0.851 . . . . 0.0 110.876 174.989 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -59.41 -39.49 83.61 Favored 'General case' 0 C--O 1.221 -0.43 0 CA-C-O 117.711 -1.138 . . . . 0.0 111.349 177.35 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 7.6 t -68.14 -35.39 78.0 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 120.294 1.406 . . . . 0.0 111.239 179.396 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 83.8 m-20 -65.1 -33.48 76.13 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 115.184 1.55 . . . . 0.0 115.184 171.9 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 58.4 t-105 -83.72 -32.14 25.67 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 125.08 1.352 . . . . 0.0 113.235 175.505 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 18.4 t-20 -75.2 -14.02 60.5 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 127.133 2.173 . . . . 0.0 111.982 172.47 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 8.6 mm-40 -82.45 -4.78 58.02 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 126.676 1.99 . . . . 0.0 113.846 162.705 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 574' ' ' HIS . . . . . . . . . . . . 0.251 69.4 m-70 57.47 27.92 14.7 Favored 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 126.268 1.827 . . . . 0.0 114.735 -179.376 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 22.4 mtpp -72.35 161.82 30.31 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 126.322 1.849 . . . . 0.0 112.893 179.293 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -59.88 105.05 0.34 Allowed 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.184 1.394 . . . . 0.0 113.546 179.109 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 58.6 tp -56.95 -42.58 80.37 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 126.017 1.727 . . . . 0.0 112.283 -174.528 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 15.2 pm0 -55.96 -33.07 64.44 Favored 'General case' 0 CA--C 1.542 0.662 0 N-CA-C 114.545 1.313 . . . . 0.0 114.545 178.257 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 2.0 tppp? -88.98 -43.48 11.1 Favored 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 125.447 1.499 . . . . 0.0 110.786 177.924 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 87.2 m -74.83 -24.54 58.62 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 126.457 1.903 . . . . 0.0 115.146 -173.474 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 46.9 ptt85 -63.56 165.62 7.81 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 125.035 1.334 . . . . 0.0 113.585 177.598 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -172.6 174.9 45.76 Favored Glycine 0 CA--C 1.525 0.701 0 CA-C-N 115.031 -0.986 . . . . 0.0 114.639 165.534 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 32.7 m -91.97 144.51 9.11 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 C-N-CA 124.264 1.026 . . . . 0.0 111.085 166.221 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 38.3 p90 -138.24 154.38 73.85 Favored Pre-proline 0 CA--C 1.539 0.543 0 C-N-CA 125.02 1.328 . . . . 0.0 113.055 177.183 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 65.2 Cg_endo -66.71 108.79 1.51 Allowed 'Trans proline' 0 N--CA 1.457 -0.649 0 C-N-CA 121.786 1.657 . . . . 0.0 109.141 170.259 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -58.83 -21.57 56.92 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 124.01 0.924 . . . . 0.0 113.27 -178.717 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 10.5 p-10 -73.45 -8.19 54.85 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 125.752 1.621 . . . . 0.0 114.16 174.147 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 13.0 m-85 -82.7 -16.5 47.9 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 116.047 1.869 . . . . 0.0 116.047 168.036 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 589' ' ' THR . . . . . 0.558 HG22 ' HA ' ' A' ' 527' ' ' ALA . 17.7 p -122.13 -179.99 4.35 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.449 1.5 . . . . 0.0 108.452 -172.112 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -140.92 142.55 34.41 Favored 'General case' 0 CA--C 1.536 0.429 0 O-C-N 120.721 -1.237 . . . . 0.0 110.23 171.021 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -52.37 135.73 32.58 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 125.407 1.483 . . . . 0.0 110.811 172.968 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 592' ' ' VAL . . . . . 0.473 HG23 ' HB2' ' A' ' 524' ' ' LYS . 1.7 m -135.6 152.58 76.53 Favored Pre-proline 0 N--CA 1.475 0.816 0 C-N-CA 125.574 1.55 . . . . 0.0 109.412 175.055 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 593' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_endo . . . . . 0 C--O 1.253 1.235 0 C-N-CA 124.588 3.525 . . . . 0.0 112.956 178.833 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B 1728 ' ' SER . . . . . . . . . . . . . 32.7 p . . . . . 0 N--CA 1.474 0.744 0 CA-C-O 119.632 -0.223 . . . . 0.0 110.492 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B 1729 ' ' THR . . . . . . . . . . . . . 8.4 t -70.92 -32.53 69.48 Favored 'General case' 0 N--CA 1.485 1.314 0 N-CA-C 114.235 1.198 . . . . 0.0 114.235 177.162 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B 1730 ' ' VAL . . . . . . . . . . . . . 5.5 m -73.52 152.84 89.76 Favored Pre-proline 0 CA--C 1.542 0.667 0 C-N-CA 126.562 1.945 . . . . 0.0 113.089 179.461 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -71.03 161.73 45.08 Favored 'Trans proline' 0 CA--C 1.54 0.792 0 C-N-CA 122.738 2.292 . . . . 0.0 113.865 -176.579 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 6.8 p -135.05 126.36 46.45 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.706 0 C-N-CA 126.364 1.865 . . . . 0.0 110.387 -177.692 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -65.49 135.9 95.99 Favored Pre-proline 0 CA--C 1.546 0.801 0 O-C-N 121.172 -0.955 . . . . 0.0 111.778 -175.515 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 4.5 Cg_endo -69.07 162.81 40.19 Favored 'Trans proline' 0 CA--C 1.539 0.752 0 C-N-CA 122.292 1.995 . . . . 0.0 112.179 177.896 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -63.07 154.64 66.02 Favored 'Trans proline' 0 CA--C 1.538 0.696 0 C-N-CA 122.537 2.158 . . . . 0.0 111.842 168.345 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B 1736 ' ' ARG . . . . . . . . . . . . . 46.0 mtp180 -114.85 171.3 7.73 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 125.401 1.481 . . . . 0.0 113.062 177.877 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B 1737 ' ' ARG . . . . . . . . . . . . . 14.5 mmt180 -118.02 135.02 54.43 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 125.483 1.513 . . . . 0.0 111.529 175.434 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B 1738 ' ' ARG . . . . . . . . . . . . . 4.1 tpm_? -64.46 -41.7 96.37 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 124.361 1.065 . . . . 0.0 110.073 163.219 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B 1739 ' ' ARG . . . . . . . . . . . . . 8.5 tpp180 -151.2 142.61 23.43 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 125.966 1.707 . . . . 0.0 109.702 160.034 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B 1740 ' ' GLY . . . . . . . . . . . . . . . -62.79 157.55 38.36 Favored Glycine 0 CA--C 1.531 1.083 0 C-N-CA 124.147 0.879 . . . . 0.0 114.769 -174.5 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B 1741 ' ' ARG . . . . . . . . . . . . . 14.2 tpp180 -116.83 117.6 30.17 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 124.947 1.299 . . . . 0.0 110.425 174.74 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B 1742 ' ' ASN . . . . . . . . . . . . . 55.2 t30 -81.84 138.89 35.01 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 123.205 0.602 . . . . 0.0 110.906 171.07 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B 1743 ' ' LEU . . . . . . . . . . . . . 94.1 mt -132.32 122.93 25.87 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 124.966 1.306 . . . . 0.0 108.067 167.534 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B 1744 ' ' THR . . . . . . . . . . . . 0.33 0.6 OUTLIER . . . . . 0 C--O 1.25 1.123 0 N-CA-C 117.306 2.336 . . . . 0.0 117.306 -168.12 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 513' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.241 0 N-CA-C 110.881 -0.888 . . . . 0.0 110.881 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 514' ' ' ARG . . . . . . . . . . . . . 5.3 mmm180 -130.5 146.77 52.1 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 126.552 1.941 . . . . 0.0 112.814 178.987 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 39.9 tp -74.02 -20.15 60.41 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 125.629 1.571 . . . . 0.0 114.385 -179.012 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 516' ' ' ASP . . . . . . . . . . . . . 21.6 t0 -112.56 145.91 39.48 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 124.841 1.257 . . . . 0.0 112.202 174.83 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 517' ' ' LEU . . . . . 0.415 HD22 HD22 ' A' ' 548' ' ' LEU . 11.0 mt -121.56 161.38 41.85 Favored Pre-proline 0 CA--C 1.542 0.652 0 C-N-CA 126.123 1.769 . . . . 0.0 111.517 -176.172 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_endo -68.06 159.36 53.39 Favored 'Trans proline' 0 CA--C 1.54 0.796 0 C-N-CA 123.458 2.772 . . . . 0.0 113.709 -173.768 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -62.92 126.78 18.78 Favored 'Trans proline' 0 C--N 1.347 0.492 0 C-N-CA 123.763 2.976 . . . . 0.0 111.182 -178.44 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 78.72 1.19 83.02 Favored Glycine 0 CA--C 1.533 1.172 0 CA-C-O 117.385 -1.786 . . . . 0.0 115.653 -177.265 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 27.1 t80 -34.84 137.22 0.13 Allowed 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 117.192 2.293 . . . . 0.0 117.192 179.222 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 39.6 mtm -106.29 -61.85 1.46 Allowed 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 123.891 0.876 . . . . 0.0 111.928 -178.073 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 523' ' ' PHE . . . . . . . . . . . . . 23.9 p90 -161.06 170.17 21.02 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 127.28 2.232 . . . . 0.0 112.082 -172.724 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 524' ' ' LYS . . . . . 0.603 ' HB2' HG23 ' A' ' 592' ' ' VAL . 71.9 mttt -104.9 163.83 12.24 Favored 'General case' 0 N--CA 1.467 0.399 0 O-C-N 121.148 -0.97 . . . . 0.0 111.288 170.358 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 8.3 m -132.4 156.53 42.5 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.881 0 C-N-CA 126.299 1.84 . . . . 0.0 109.651 165.894 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 44.2 tt0 -118.38 129.87 55.67 Favored 'General case' 0 N--CA 1.477 0.877 0 CA-C-N 119.795 1.18 . . . . 0.0 111.913 169.394 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 527' ' ' ALA . . . . . 0.513 ' HA ' HG22 ' A' ' 589' ' ' THR . . . -62.11 121.8 13.96 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.155 0.982 . . . . 0.0 111.786 177.766 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 71.7 mm-40 -89.49 -18.15 27.26 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 125.957 1.703 . . . . 0.0 111.978 172.978 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 98.7 m-70 -144.93 161.5 39.2 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 127.577 2.351 . . . . 0.0 109.759 -175.443 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -89.5 133.06 34.74 Favored 'General case' 0 C--O 1.237 0.429 0 N-CA-C 107.079 -1.452 . . . . 0.0 107.079 -179.524 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 88.2 t80 -122.61 106.19 10.76 Favored 'General case' 0 C--O 1.235 0.306 0 C-N-CA 124.772 1.229 . . . . 0.0 113.232 177.59 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -80.6 113.84 19.07 Favored 'General case' 0 N--CA 1.469 0.503 0 N-CA-C 113.251 0.834 . . . . 0.0 113.251 170.071 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -71.47 141.63 50.21 Favored 'General case' 0 C--O 1.238 0.485 0 C-N-CA 125.244 1.418 . . . . 0.0 111.881 179.747 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 5.7 t -110.65 -37.01 5.57 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 126.178 1.791 . . . . 0.0 113.455 177.92 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 84.8 m-20 -95.11 152.48 18.31 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 116.968 2.21 . . . . 0.0 116.968 -177.547 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 4.2 t -57.12 -26.89 61.24 Favored 'General case' 0 N--CA 1.481 1.084 0 N-CA-C 116.138 1.903 . . . . 0.0 116.138 179.812 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 537' ' ' ASP . . . . . 0.48 ' CG ' HH22 ' B' 1736 ' ' ARG . 8.2 p30 -92.61 -9.37 41.27 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 116.788 2.144 . . . . 0.0 116.788 174.742 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 86.3 mt-10 -75.69 152.11 37.58 Favored 'General case' 0 CA--C 1.537 0.457 0 O-C-N 120.96 -1.088 . . . . 0.0 113.913 -177.951 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -97.97 132.48 43.5 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 127.561 2.344 . . . . 0.0 109.521 171.577 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 30.0 tt0 -90.03 134.45 34.23 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.037 0.935 . . . . 0.0 111.519 174.912 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 83.1 mt -127.63 155.36 44.0 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 125.007 1.323 . . . . 0.0 112.819 -178.196 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -129.12 142.31 50.92 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 125.556 1.542 . . . . 0.0 109.728 174.029 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -54.8 105.89 0.18 Allowed 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.34 1.056 . . . . 0.0 112.04 -175.616 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 125.43 -15.01 7.24 Favored Glycine 0 CA--C 1.531 1.061 0 C-N-CA 126.684 2.087 . . . . 0.0 113.814 -176.627 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 84.9 m-20 -73.83 119.64 18.33 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 114.909 1.448 . . . . 0.0 114.909 -171.164 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 21.8 t -70.14 137.78 23.34 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 O-C-N 122.057 -0.402 . . . . 0.0 110.83 169.178 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 1.1 t -125.84 127.55 71.36 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 C-N-CA 126.538 1.935 . . . . 0.0 111.399 174.957 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 548' ' ' LEU . . . . . 0.439 ' CD2' ' HE2' ' A' ' 524' ' ' LYS . 20.4 mt -83.76 101.7 11.78 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.356 1.063 . . . . 0.0 108.742 177.495 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 549' ' ' VAL . . . . . . . . . . . . . 6.3 t -63.88 131.12 29.43 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 N-CA-C 113.986 1.106 . . . . 0.0 113.986 174.436 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 24.6 pt -127.11 157.25 72.79 Favored Pre-proline 0 CA--C 1.548 0.87 0 C-N-CA 126.426 1.89 . . . . 0.0 110.276 177.606 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -70.93 156.43 60.3 Favored 'Trans proline' 0 CA--C 1.534 0.519 0 C-N-CA 123.779 2.986 . . . . 0.0 111.54 174.498 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 54.9 m-85 -72.19 151.22 43.08 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 115.72 1.748 . . . . 0.0 115.72 175.998 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 553' ' ' GLN . . . . . . . . . . . . . 6.2 pt20 -63.39 -29.51 70.8 Favored 'General case' 0 CA--C 1.544 0.712 0 O-C-N 121.487 -0.758 . . . . 0.0 112.659 169.397 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 3.8 m-20 -156.22 153.19 24.83 Favored Pre-proline 0 CA--C 1.545 0.781 0 C-N-CA 125.332 1.453 . . . . 0.0 111.95 -175.645 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 555' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_endo -70.41 -29.61 20.49 Favored 'Trans proline' 0 CA--C 1.539 0.726 0 C-N-CA 123.813 3.009 . . . . 0.0 112.712 -178.601 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 23.7 pt-20 -73.66 -14.8 61.22 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 124.862 1.265 . . . . 0.0 112.736 176.672 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 557' ' ' GLU . . . . . . . . . . . . . 73.7 mm-40 -84.64 -20.9 30.59 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 123.991 0.916 . . . . 0.0 113.206 -178.106 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 4.1 tp60 -75.15 147.06 40.81 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 125.505 1.522 . . . . 0.0 113.178 176.076 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 13.0 m-20 -120.3 156.29 31.56 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 128.173 2.589 . . . . 0.0 116.125 178.66 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -71.31 110.86 6.21 Favored 'General case' 0 N--CA 1.473 0.716 0 O-C-N 120.345 -1.472 . . . . 0.0 114.093 -165.783 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 82.69 7.63 87.13 Favored Glycine 0 CA--C 1.539 1.545 0 O-C-N 121.117 -0.989 . . . . 0.0 114.605 -175.415 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 47.6 m95 -89.64 165.96 13.91 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 126.013 1.725 . . . . 0.0 113.456 176.407 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 18.9 mt -138.48 158.05 45.0 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 126.003 1.721 . . . . 0.0 110.317 170.4 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 47.8 ttm -115.32 142.78 46.23 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 125.058 1.343 . . . . 0.0 112.078 174.011 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -171.8 -174.8 39.61 Favored Glycine 0 CA--C 1.527 0.812 0 C-N-CA 123.771 0.701 . . . . 0.0 113.328 178.056 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 12.1 p -128.11 141.23 47.02 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.829 0 C-N-CA 125.742 1.617 . . . . 0.0 109.15 171.384 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 31.8 mtmt -57.72 136.56 56.89 Favored 'General case' 0 N--CA 1.467 0.411 0 O-C-N 121.328 -0.858 . . . . 0.0 111.563 175.519 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 15.9 tt0 -58.06 -43.58 86.99 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 118.555 -0.736 . . . . 0.0 110.909 176.809 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 38.5 t -65.68 -36.25 83.1 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-N 118.932 0.787 . . . . 0.0 112.583 178.172 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 79.4 m-20 -65.3 -42.53 92.97 Favored 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 114.828 1.418 . . . . 0.0 114.828 173.515 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 72.9 t-105 -69.04 -35.55 76.72 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.564 1.146 . . . . 0.0 112.92 173.914 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 50.9 t-20 -69.06 -31.35 70.05 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 127.429 2.292 . . . . 0.0 111.737 173.891 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 12.5 mm-40 -82.45 0.74 40.84 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.966 1.306 . . . . 0.0 114.149 172.373 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 83.6 m-70 57.26 38.31 28.63 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 126.753 2.021 . . . . 0.0 113.706 178.268 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 22.3 mtpp -86.31 159.05 19.53 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 125.595 1.558 . . . . 0.0 111.043 179.881 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 12.6 pm0 -56.49 98.71 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 115.029 1.492 . . . . 0.0 115.029 -167.179 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 44.6 tp -50.64 -47.18 58.53 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 125.042 1.337 . . . . 0.0 112.665 -173.229 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 72.4 mm-40 -66.27 -12.64 57.62 Favored 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 114.371 1.248 . . . . 0.0 114.371 -174.124 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 13.1 tptp -117.83 -33.16 4.59 Favored 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 125.501 1.521 . . . . 0.0 113.173 177.684 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 71.1 m -65.22 -31.83 73.19 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 125.635 1.574 . . . . 0.0 112.504 173.119 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 29.6 ptt85 -60.1 157.07 13.73 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 123.737 0.815 . . . . 0.0 112.668 172.215 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -171.96 173.91 45.21 Favored Glycine 0 CA--C 1.524 0.62 0 C-N-CA 123.991 0.805 . . . . 0.0 113.205 173.707 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 35.1 m -91.37 141.43 14.47 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.428 0 C-N-CA 124.008 0.923 . . . . 0.0 110.982 169.356 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 50.5 p90 -137.74 154.6 74.89 Favored Pre-proline 0 CA--C 1.538 0.498 0 C-N-CA 123.959 0.903 . . . . 0.0 113.125 175.838 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_endo -70.37 110.07 2.59 Favored 'Trans proline' 0 N--CA 1.458 -0.613 0 C-N-CA 122.207 1.938 . . . . 0.0 110.034 172.11 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 20.8 pt-20 -55.83 -26.53 47.08 Favored 'General case' 0 N--CA 1.474 0.756 0 O-C-N 121.308 -0.87 . . . . 0.0 112.675 -178.805 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 6.6 p-10 -65.35 -15.36 62.48 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 126.131 1.772 . . . . 0.0 114.48 178.199 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 27.5 m-85 -77.48 -10.99 59.79 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 116.582 2.068 . . . . 0.0 116.582 165.537 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 589' ' ' THR . . . . . 0.513 HG22 ' HA ' ' A' ' 527' ' ' ALA . 80.6 p -131.27 169.78 15.5 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 126.131 1.772 . . . . 0.0 111.734 -171.806 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -125.23 142.45 51.49 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 123.987 0.915 . . . . 0.0 110.228 172.23 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.55 134.5 56.18 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 125.252 1.421 . . . . 0.0 110.999 172.009 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 592' ' ' VAL . . . . . 0.603 HG23 ' HB2' ' A' ' 524' ' ' LYS . 5.4 m -126.67 151.53 73.42 Favored Pre-proline 0 CA--C 1.553 1.06 0 C-N-CA 124.785 1.234 . . . . 0.0 111.584 -178.546 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 593' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo . . . . . 0 C--O 1.252 1.209 1 C-N-CA 125.707 4.272 . . . . 0.0 117.182 -168.451 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B 1728 ' ' SER . . . . . . . . . . . . . 12.2 t . . . . . 0 N--CA 1.473 0.712 0 CA-C-O 120.597 0.237 . . . . 0.0 110.553 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B 1729 ' ' THR . . . . . . . . . . . . 0.387 0.2 OUTLIER 62.12 27.01 16.28 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 116.92 2.193 . . . . 0.0 116.92 176.044 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B 1730 ' ' VAL . . . . . . . . . . . . 0.292 1.1 m -111.84 142.55 26.9 Favored Pre-proline 0 N--CA 1.479 1.023 0 C-N-CA 125.139 1.375 . . . . 0.0 114.482 174.588 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 49.8 Cg_endo -69.58 178.17 4.72 Favored 'Trans proline' 0 CA--C 1.547 1.125 0 C-N-CA 124.77 3.646 . . . . 0.0 115.25 -176.675 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 60.3 t -132.65 129.87 58.93 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.068 0 C-N-CA 125.9 1.68 . . . . 0.0 110.73 178.572 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -65.08 131.41 95.15 Favored Pre-proline 0 CA--C 1.556 1.185 0 O-C-N 121.481 -0.762 . . . . 0.0 112.924 -177.348 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 50.4 Cg_endo -74.06 157.3 46.83 Favored 'Trans proline' 0 CA--C 1.541 0.842 0 C-N-CA 123.105 2.537 . . . . 0.0 114.111 -170.15 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -65.71 117.25 4.46 Favored 'Trans proline' 0 CA--C 1.535 0.56 0 C-N-CA 123.808 3.005 . . . . 0.0 112.802 -172.291 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B 1736 ' ' ARG . . . . . 0.48 HH22 ' CG ' ' A' ' 537' ' ' ASP . 83.2 mtp180 -78.47 149.5 33.19 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 125.346 1.458 . . . . 0.0 111.204 176.07 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B 1737 ' ' ARG . . . . . . . . . . . . . 12.9 mtp180 -87.81 -176.82 5.64 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 126.525 1.93 . . . . 0.0 112.027 -173.043 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B 1738 ' ' ARG . . . . . . . . . . . . . 66.1 mtt-85 -84.85 136.07 33.81 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 123.511 0.724 . . . . 0.0 110.041 158.745 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B 1739 ' ' ARG . . . . . . . . . . . . . 15.0 mtt85 -69.22 -28.57 66.48 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 126.336 1.854 . . . . 0.0 113.914 173.342 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B 1740 ' ' GLY . . . . . . . . . . . . . . . 179.24 -176.04 47.56 Favored Glycine 0 CA--C 1.531 1.069 0 N-CA-C 114.388 0.515 . . . . 0.0 114.388 -176.346 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B 1741 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.36 142.77 58.27 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.16 0.984 . . . . 0.0 111.407 175.246 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B 1742 ' ' ASN . . . . . . . . . . . . . 75.7 m-20 -77.09 89.97 3.61 Favored 'General case' 0 C--O 1.238 0.472 0 C-N-CA 124.455 1.102 . . . . 0.0 110.741 175.883 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B 1743 ' ' LEU . . . . . . . . . . . . . 51.4 tp -158.65 124.92 4.6 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 127.248 2.219 . . . . 0.0 109.03 -178.477 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B 1744 ' ' THR . . . . . . . . . . . . . 2.2 t . . . . . 0 C--O 1.25 1.087 0 C-N-CA 124.95 1.3 . . . . 0.0 114.224 -179.584 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 513' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.804 0 N-CA-C 110.32 -1.112 . . . . 0.0 110.32 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 514' ' ' ARG . . . . . . . . . . . . . 2.4 mmp_? -121.47 152.97 38.53 Favored 'General case' 0 N--CA 1.48 1.047 0 N-CA-C 114.839 1.422 . . . . 0.0 114.839 178.477 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 5.9 mp -86.13 -3.66 59.0 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 124.962 1.305 . . . . 0.0 112.756 174.149 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 516' ' ' ASP . . . . . . . . . . . . . 32.5 p-10 -134.75 133.57 40.05 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 126.538 1.935 . . . . 0.0 114.873 178.284 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 517' ' ' LEU . . . . . 0.408 HD22 HD22 ' A' ' 548' ' ' LEU . 10.6 mt -121.96 160.88 45.25 Favored Pre-proline 0 CA--C 1.552 1.042 0 N-CA-C 114.61 1.337 . . . . 0.0 114.61 -164.172 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -71.0 161.14 47.12 Favored 'Trans proline' 0 CA--C 1.541 0.867 0 C-N-CA 124.655 3.57 . . . . 0.0 113.981 -172.205 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -68.19 123.95 11.19 Favored 'Trans proline' 0 C--O 1.239 0.542 0 C-N-CA 123.481 2.787 . . . . 0.0 111.818 -173.488 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 82.15 1.53 90.37 Favored Glycine 0 CA--C 1.537 1.415 0 CA-C-O 117.757 -1.579 . . . . 0.0 115.808 -175.454 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 30.6 t80 -34.18 132.02 0.28 Allowed 'General case' 0 CA--C 1.546 0.808 0 N-CA-C 118.435 2.754 . . . . 0.0 118.435 -178.53 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 31.7 mtm -101.59 -53.93 2.87 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 113.479 0.918 . . . . 0.0 113.479 -176.732 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 523' ' ' PHE . . . . . 0.46 ' CE1' HG21 ' A' ' 549' ' ' VAL . 19.3 p90 -170.02 171.09 7.21 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 126.508 1.923 . . . . 0.0 111.893 -173.299 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 524' ' ' LYS . . . . . 0.516 ' HE2' ' CD2' ' A' ' 548' ' ' LEU . 76.5 mttt -104.61 163.21 12.64 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-O 122.228 1.013 . . . . 0.0 111.684 167.904 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 12.3 m -134.34 162.44 39.01 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 126.552 1.941 . . . . 0.0 109.55 165.317 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 52.5 tt0 -127.28 129.8 48.38 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 119.035 0.834 . . . . 0.0 112.137 171.136 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 527' ' ' ALA . . . . . 0.569 ' HA ' HG22 ' A' ' 589' ' ' THR . . . -62.84 129.62 41.27 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.119 0.967 . . . . 0.0 111.302 -178.644 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 62.6 mm-40 -98.08 -12.8 21.46 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 124.915 1.286 . . . . 0.0 112.708 173.461 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 89.0 m-70 -146.74 160.14 42.6 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 128.064 2.545 . . . . 0.0 109.243 -179.87 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 21.4 p-10 -78.53 146.14 34.47 Favored 'General case' 0 N--CA 1.466 0.375 0 O-C-N 121.432 -0.792 . . . . 0.0 111.853 170.061 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 79.3 t80 -139.72 118.27 12.24 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 124.999 1.32 . . . . 0.0 110.846 175.71 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 2.2 m -91.57 132.14 36.51 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 124.909 1.284 . . . . 0.0 113.883 173.546 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -71.19 120.83 17.33 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 123.584 0.754 . . . . 0.0 112.321 -171.208 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 2.4 p -89.23 -5.53 57.58 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 126.216 1.807 . . . . 0.0 115.763 177.595 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 8.6 t0 -147.21 158.79 44.08 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.266 1.026 . . . . 0.0 108.905 178.971 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 6.3 t -59.79 -23.08 62.99 Favored 'General case' 0 N--CA 1.477 0.914 0 N-CA-C 115.061 1.504 . . . . 0.0 115.061 169.567 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 23.3 t0 -75.62 -33.75 60.54 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 124.512 1.125 . . . . 0.0 110.686 174.771 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 83.6 mt-10 -73.57 147.22 44.11 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.011 1.325 . . . . 0.0 113.345 -171.071 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -92.52 138.16 31.75 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 127.275 2.23 . . . . 0.0 109.825 175.123 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 14.0 tt0 -94.07 119.54 33.07 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 123.956 0.902 . . . . 0.0 111.316 175.492 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 59.5 mt -111.59 142.17 44.23 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 124.447 1.099 . . . . 0.0 111.76 179.272 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 16.0 tptp -106.18 142.19 36.29 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 124.737 1.215 . . . . 0.0 109.816 162.498 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -47.49 121.55 4.03 Favored 'General case' 0 CA--C 1.544 0.726 0 CA-C-O 121.657 0.742 . . . . 0.0 110.881 173.66 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 98.05 -3.81 60.51 Favored Glycine 0 CA--C 1.53 0.998 0 C-N-CA 125.191 1.377 . . . . 0.0 114.127 -178.715 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 82.0 m-20 -67.5 122.11 17.27 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 118.798 1.299 . . . . 0.0 114.228 174.854 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 2.3 t -74.89 135.19 27.84 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 CA-C-N 118.554 0.615 . . . . 0.0 111.552 165.889 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -125.31 121.5 60.69 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 C-N-CA 125.443 1.497 . . . . 0.0 111.744 177.494 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 548' ' ' LEU . . . . . 0.516 ' CD2' ' HE2' ' A' ' 524' ' ' LYS . 17.8 mt -77.13 99.28 5.33 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.609 1.164 . . . . 0.0 108.595 175.241 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 549' ' ' VAL . . . . . 0.46 HG21 ' CE1' ' A' ' 523' ' ' PHE . 2.8 t -60.58 128.48 21.79 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.955 0 N-CA-C 114.011 1.115 . . . . 0.0 114.011 171.142 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 8.7 pt -123.82 154.06 67.22 Favored Pre-proline 0 CA--C 1.547 0.852 0 C-N-CA 126.438 1.895 . . . . 0.0 109.749 177.485 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -70.6 148.9 60.66 Favored 'Trans proline' 0 N--CA 1.461 -0.429 0 C-N-CA 123.653 2.902 . . . . 0.0 110.129 173.862 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 46.7 m-85 -69.32 140.97 54.37 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 114.386 1.254 . . . . 0.0 114.386 176.075 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 553' ' ' GLN . . . . . 0.522 ' CD ' ' H ' ' A' ' 553' ' ' GLN . 0.0 OUTLIER -67.24 -20.33 65.66 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 128.146 2.578 . . . . 0.0 115.225 170.934 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 37.8 m-20 -151.39 154.34 33.49 Favored Pre-proline 0 CA--C 1.549 0.94 0 C-N-CA 125.524 1.529 . . . . 0.0 112.899 -175.426 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 555' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -73.71 -39.6 1.82 Allowed 'Trans proline' 0 CA--C 1.538 0.724 0 C-N-CA 123.712 2.941 . . . . 0.0 113.214 -179.746 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 26.0 pt-20 -82.49 -16.73 47.71 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.311 1.044 . . . . 0.0 113.761 -177.735 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 557' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -69.42 -24.74 63.88 Favored 'General case' 0 CA--C 1.543 0.689 0 O-C-N 121.474 -0.766 . . . . 0.0 112.031 168.878 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 50.6 tt0 -80.29 120.4 24.31 Favored 'General case' 0 C--O 1.234 0.25 0 C-N-CA 124.348 1.059 . . . . 0.0 112.722 -176.856 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 68.9 m-20 -94.24 151.82 19.16 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 125.328 1.451 . . . . 0.0 114.109 177.775 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 80.7 tt0 -82.28 119.16 23.75 Favored 'General case' 0 CA--C 1.541 0.597 0 O-C-N 121.053 -1.029 . . . . 0.0 111.907 -167.866 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 81.94 1.58 90.31 Favored Glycine 0 CA--C 1.543 1.797 0 C-N-CA 124.327 0.965 . . . . 0.0 114.834 -171.352 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 47.5 m95 -94.38 167.01 11.79 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 126.78 2.032 . . . . 0.0 113.253 176.45 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 22.7 mt -139.56 159.7 41.55 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 125.192 1.397 . . . . 0.0 110.887 169.933 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 46.0 ttm -115.17 143.84 44.6 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 125.501 1.52 . . . . 0.0 112.712 176.238 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -167.34 -173.44 35.53 Favored Glycine 0 CA--C 1.525 0.705 0 C-N-CA 124.057 0.837 . . . . 0.0 113.374 175.063 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 14.3 p -129.84 142.03 44.9 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 C-N-CA 125.836 1.655 . . . . 0.0 109.477 170.989 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 34.0 mtmt -59.04 132.61 54.56 Favored 'General case' 0 N--CA 1.467 0.421 0 O-C-N 121.428 -0.795 . . . . 0.0 111.929 176.189 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 18.3 tt0 -59.42 -42.61 92.23 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 118.473 -0.775 . . . . 0.0 111.124 178.758 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 34.0 t -65.31 -30.79 71.68 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 119.254 0.934 . . . . 0.0 111.963 178.699 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -70.6 -40.77 73.02 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 115.086 1.513 . . . . 0.0 115.086 173.1 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 64.3 t-105 -71.06 -30.42 66.56 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.217 1.407 . . . . 0.0 112.992 172.116 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 10.1 t-20 -67.52 -34.03 76.28 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 126.472 1.909 . . . . 0.0 111.585 172.161 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 35.4 mt-30 -80.77 -0.07 36.98 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 124.886 1.275 . . . . 0.0 113.44 168.0 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 9.0 m-70 53.78 37.43 26.31 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 126.061 1.744 . . . . 0.0 112.943 179.444 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 6.0 mtpm? -73.17 156.46 38.59 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 125.05 1.34 . . . . 0.0 110.854 175.882 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 12.1 pm0 -57.35 105.79 0.27 Allowed 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 125.038 1.335 . . . . 0.0 114.159 -167.919 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 55.2 tp -55.25 -48.15 74.39 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 124.505 1.122 . . . . 0.0 112.814 -170.139 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 1.2 pp20? -66.29 -16.45 64.05 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 125.253 1.421 . . . . 0.0 114.651 -175.401 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 32.3 mmtm -106.74 -37.51 6.38 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.681 1.193 . . . . 0.0 112.671 173.213 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 91.2 m -68.47 -28.57 67.15 Favored 'General case' 0 CA--C 1.537 0.479 0 N-CA-C 112.93 0.715 . . . . 0.0 112.93 -179.816 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 38.4 ptt85 -64.29 156.99 27.24 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 113.223 0.823 . . . . 0.0 113.223 176.757 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -169.85 171.04 43.18 Favored Glycine 0 N--CA 1.466 0.697 0 CA-C-N 115.765 -0.652 . . . . 0.0 114.52 176.354 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 17.4 m -90.44 137.16 22.17 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 C-N-CA 124.753 1.221 . . . . 0.0 112.236 172.403 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 48.0 p90 -135.15 155.29 79.07 Favored Pre-proline 0 C--O 1.241 0.629 0 C-N-CA 124.502 1.121 . . . . 0.0 112.932 176.832 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_endo -69.83 109.2 2.27 Favored 'Trans proline' 0 N--CA 1.455 -0.785 0 C-N-CA 121.773 1.649 . . . . 0.0 109.359 169.84 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 20.3 pt-20 -54.41 -23.5 16.08 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 124.16 0.984 . . . . 0.0 113.578 -179.805 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 9.7 p-10 -77.84 -11.29 59.87 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 127.151 2.181 . . . . 0.0 114.755 177.858 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 11.6 m-85 -75.67 -15.76 60.28 Favored 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 116.733 2.123 . . . . 0.0 116.733 162.294 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 589' ' ' THR . . . . . 0.569 HG22 ' HA ' ' A' ' 527' ' ' ALA . 40.8 p -120.16 174.34 6.56 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 125.495 1.518 . . . . 0.0 109.479 -174.596 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -122.34 139.33 53.95 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 123.871 0.869 . . . . 0.0 109.313 172.192 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.03 116.09 8.28 Favored 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 108.088 -1.079 . . . . 0.0 108.088 176.667 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 592' ' ' VAL . . . . . 0.477 HG23 ' HB2' ' A' ' 524' ' ' LYS . 4.6 m -96.43 151.92 38.35 Favored Pre-proline 0 N--CA 1.474 0.757 0 C-N-CA 124.623 1.169 . . . . 0.0 108.062 175.743 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 593' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo . . . . . 0 C--O 1.254 1.307 0 C-N-CA 124.026 3.151 . . . . 0.0 116.769 -159.067 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B 1728 ' ' SER . . . . . . . . . . . . . 46.8 t . . . . . 0 N--CA 1.473 0.71 0 N-CA-C 112.833 0.679 . . . . 0.0 112.833 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B 1729 ' ' THR . . . . . . . . . . . . . 1.4 t -70.52 -34.0 71.82 Favored 'General case' 0 N--CA 1.477 0.925 0 N-CA-C 117.476 2.399 . . . . 0.0 117.476 -176.948 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B 1730 ' ' VAL . . . . . . . . . . . . . 2.2 m -79.39 149.59 72.42 Favored Pre-proline 0 N--CA 1.477 0.888 0 C-N-CA 124.601 1.16 . . . . 0.0 112.86 177.654 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -61.92 161.97 23.85 Favored 'Trans proline' 0 CA--C 1.536 0.615 0 C-N-CA 123.409 2.739 . . . . 0.0 112.397 176.026 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 5.9 t -125.57 129.64 72.75 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.858 0 C-N-CA 124.777 1.231 . . . . 0.0 112.41 -176.624 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -69.34 141.52 91.24 Favored Pre-proline 0 CA--C 1.548 0.896 0 O-C-N 121.818 -0.551 . . . . 0.0 112.163 -177.112 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 3.6 Cg_endo -66.1 162.32 36.12 Favored 'Trans proline' 0 CA--C 1.541 0.864 0 C-N-CA 122.541 2.161 . . . . 0.0 112.596 172.912 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -53.99 162.15 4.23 Favored 'Trans proline' 0 CA--C 1.54 0.788 0 C-N-CA 123.195 2.597 . . . . 0.0 112.809 163.435 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B 1736 ' ' ARG . . . . . . . . . . . . . 27.7 mtp-105 -124.22 138.96 54.34 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 125.577 1.551 . . . . 0.0 111.183 174.121 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B 1737 ' ' ARG . . . . . . . . . . . . . 11.3 mmm-85 -72.94 -31.23 64.46 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 126.152 1.781 . . . . 0.0 110.071 176.506 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B 1738 ' ' ARG . . . . . . . . . . . . . 60.8 ttt180 49.18 81.68 0.05 Allowed 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 127.957 2.503 . . . . 0.0 113.568 163.122 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B 1739 ' ' ARG . . . . . . . . . . . . . 6.5 ppt_? -67.43 153.47 43.61 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 124.518 1.127 . . . . 0.0 112.692 178.081 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B 1740 ' ' GLY . . . . . . . . . . . . . . . -172.76 -139.15 2.76 Favored Glycine 0 CA--C 1.531 1.034 0 N-CA-C 115.114 0.806 . . . . 0.0 115.114 177.316 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B 1741 ' ' ARG . . . . . . . . . . . . . 31.8 tpt180 -63.71 130.76 45.54 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 127.083 2.153 . . . . 0.0 113.251 -173.604 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B 1742 ' ' ASN . . . . . . . . . . . . . 84.7 m-20 49.31 39.36 15.84 Favored 'General case' 0 CA--C 1.552 1.022 0 C-N-CA 125.719 1.608 . . . . 0.0 115.154 175.006 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B 1743 ' ' LEU . . . . . . . . . . . . . 64.6 tp -70.86 -25.81 62.98 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.384 1.074 . . . . 0.0 113.144 -179.503 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B 1744 ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.253 1.253 0 N-CA-C 117.583 2.438 . . . . 0.0 117.583 179.666 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 513' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 1.094 0 N-CA-C 110.44 -1.064 . . . . 0.0 110.44 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 514' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -66.11 140.05 58.2 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.341 0.656 . . . . 0.0 111.276 -176.613 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 12.6 tp -73.6 -42.95 60.85 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.498 179.438 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 516' ' ' ASP . . . . . . . . . . . . 0.305 5.3 p-10 -84.28 140.05 31.91 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 116.774 2.139 . . . . 0.0 116.774 175.529 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 517' ' ' LEU . . . . . 0.454 HD22 HD22 ' A' ' 548' ' ' LEU . 13.8 mt -129.48 158.69 72.53 Favored Pre-proline 0 CA--C 1.546 0.797 0 C-N-CA 125.813 1.645 . . . . 0.0 111.88 -165.512 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_endo -66.97 159.55 51.39 Favored 'Trans proline' 0 CA--C 1.544 0.99 0 C-N-CA 124.242 3.295 . . . . 0.0 113.932 -172.725 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_endo -61.13 121.72 10.08 Favored 'Trans proline' 0 CA--C 1.536 0.594 0 C-N-CA 123.707 2.938 . . . . 0.0 112.121 -173.298 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 77.54 4.22 84.31 Favored Glycine 0 CA--C 1.536 1.348 0 CA-C-O 117.081 -1.955 . . . . 0.0 116.27 -178.674 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 15.4 t80 -28.17 130.94 0.05 Allowed 'General case' 0 CA--C 1.547 0.851 0 N-CA-C 118.434 2.753 . . . . 0.0 118.434 178.008 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 48.5 mtm -99.41 -53.85 3.11 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 113.283 0.845 . . . . 0.0 113.283 -177.178 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 523' ' ' PHE . . . . . . . . . . . . . 17.8 p90 -166.52 165.96 16.54 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 126.439 1.896 . . . . 0.0 112.942 -172.683 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 524' ' ' LYS . . . . . 0.538 ' HE2' ' CD2' ' A' ' 548' ' ' LEU . 74.0 mttt -98.39 162.48 13.14 Favored 'General case' 0 CA--C 1.539 0.522 0 O-C-N 121.194 -0.942 . . . . 0.0 111.545 165.813 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 19.8 m -135.6 159.54 40.01 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 C-N-CA 126.546 1.938 . . . . 0.0 109.259 167.12 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 30.5 tt0 -122.04 126.86 49.43 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 124.052 0.941 . . . . 0.0 111.441 174.633 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 527' ' ' ALA . . . . . 0.485 ' HA ' HG22 ' A' ' 589' ' ' THR . . . -61.51 124.28 20.2 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 123.975 0.91 . . . . 0.0 111.629 179.253 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 38.8 mm-40 -87.38 -18.98 28.8 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 125.825 1.65 . . . . 0.0 112.232 176.751 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 97.0 m-70 -148.37 169.12 20.87 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 128.468 2.707 . . . . 0.0 109.84 -177.507 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -83.16 144.55 29.75 Favored 'General case' 0 CA--C 1.539 0.528 0 O-C-N 121.117 -0.989 . . . . 0.0 108.937 172.996 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 84.3 t80 -134.63 117.25 15.9 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 124.679 1.192 . . . . 0.0 113.234 173.489 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -86.95 116.08 24.77 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 114.335 1.235 . . . . 0.0 114.335 174.486 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -66.25 137.79 57.21 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 123.376 0.67 . . . . 0.0 112.013 177.615 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 13.4 t -112.43 -26.91 8.48 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 125.573 1.549 . . . . 0.0 114.012 175.807 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 27.4 t0 -93.64 149.98 20.79 Favored 'General case' 0 N--CA 1.473 0.721 0 O-C-N 120.857 -1.152 . . . . 0.0 108.323 175.069 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 536' ' ' THR . . . . . . . . . . . . 0.255 0.6 OUTLIER -59.2 -19.56 46.42 Favored 'General case' 0 N--CA 1.469 0.488 0 N-CA-C 115.998 1.851 . . . . 0.0 115.998 165.188 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 38.8 m-20 -82.19 -15.62 52.57 Favored 'General case' 0 CA--C 1.542 0.663 0 N-CA-C 117.625 2.454 . . . . 0.0 117.625 168.995 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 61.0 mt-10 -86.06 145.43 27.07 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 114.541 1.311 . . . . 0.0 114.541 -172.713 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -87.93 136.1 33.11 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 126.476 1.91 . . . . 0.0 110.415 174.369 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 38.9 tt0 -94.53 129.81 41.18 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 125.176 1.39 . . . . 0.0 110.83 177.478 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 81.4 mt -124.85 154.02 41.68 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 125.112 1.365 . . . . 0.0 112.146 -178.316 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 6.3 tmtm? -126.48 144.27 50.91 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 125.873 1.669 . . . . 0.0 108.223 168.739 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -47.84 117.74 2.0 Favored 'General case' 0 CA--C 1.543 0.709 0 CA-C-O 122.422 1.105 . . . . 0.0 112.267 177.598 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 103.96 -5.14 46.11 Favored Glycine 0 CA--C 1.529 0.968 0 C-N-CA 127.179 2.323 . . . . 0.0 113.577 178.287 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 75.4 m-20 -73.71 127.68 33.45 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 118.945 1.372 . . . . 0.0 114.436 -173.603 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 2.0 t -76.98 135.18 27.15 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 N-CA-C 112.473 0.546 . . . . 0.0 112.473 173.897 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 1.2 t -126.48 122.88 62.08 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 C-N-CA 125.199 1.4 . . . . 0.0 111.81 177.272 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 548' ' ' LEU . . . . . 0.538 ' CD2' ' HE2' ' A' ' 524' ' ' LYS . 17.5 mt -78.03 99.61 6.17 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 124.488 1.115 . . . . 0.0 108.636 174.56 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 549' ' ' VAL . . . . . . . . . . . . . 4.6 t -62.5 128.61 24.57 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.032 0 N-CA-C 113.666 0.987 . . . . 0.0 113.666 171.497 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 10.9 pt -119.45 153.68 53.94 Favored Pre-proline 0 N--CA 1.47 0.552 0 C-N-CA 126.138 1.775 . . . . 0.0 109.817 179.877 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 77.4 Cg_endo -67.11 142.73 62.48 Favored 'Trans proline' 0 N--CA 1.458 -0.596 0 C-N-CA 122.823 2.349 . . . . 0.0 110.443 175.981 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 552' ' ' PHE . . . . . 0.427 ' CE1' ' HA ' ' A' ' 558' ' ' GLN . 39.1 m-85 -64.35 140.43 58.87 Favored 'General case' 0 CA--C 1.53 0.179 0 N-CA-C 117.288 2.329 . . . . 0.0 117.288 -177.087 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 553' ' ' GLN . . . . . . . . . . . . . 19.5 pt20 -90.7 -15.41 30.36 Favored 'General case' 0 CA--C 1.54 0.565 0 N-CA-C 116.262 1.949 . . . . 0.0 116.262 -169.189 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -152.83 156.89 33.24 Favored Pre-proline 0 CA--C 1.544 0.741 0 C-N-CA 124.532 1.133 . . . . 0.0 110.248 168.459 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 555' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -70.86 -33.62 12.15 Favored 'Trans proline' 0 CA--C 1.535 0.529 0 C-N-CA 123.303 2.669 . . . . 0.0 112.01 -176.397 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -72.92 -14.54 61.48 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 113.211 0.819 . . . . 0.0 113.211 173.774 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 557' ' ' GLU . . . . . . . . . . . . . 65.6 mm-40 -85.77 -25.73 26.22 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 124.949 1.3 . . . . 0.0 112.6 179.515 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 558' ' ' GLN . . . . . 0.427 ' HA ' ' CE1' ' A' ' 552' ' ' PHE . 7.0 tt0 -82.44 107.41 15.08 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-O 122.035 0.921 . . . . 0.0 112.683 178.503 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . 0.296 9.1 m-20 -96.67 138.92 33.51 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 116.744 2.128 . . . . 0.0 116.744 172.775 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 17.3 tp10 -68.05 124.62 23.92 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.695 1.198 . . . . 0.0 111.007 -177.73 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 83.51 -2.99 86.42 Favored Glycine 0 CA--C 1.535 1.341 0 C-N-CA 125.134 1.349 . . . . 0.0 115.173 -171.409 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 50.2 m95 -98.93 161.3 13.7 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 125.312 1.445 . . . . 0.0 112.348 172.891 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 13.1 mt -137.31 154.94 49.98 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 124.688 1.195 . . . . 0.0 110.213 172.263 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 56.5 ttm -116.23 141.14 48.53 Favored 'General case' 0 N--CA 1.464 0.229 0 C-N-CA 124.717 1.207 . . . . 0.0 111.537 178.172 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -173.1 -171.87 38.16 Favored Glycine 0 CA--C 1.522 0.5 0 C-N-CA 123.341 0.496 . . . . 0.0 113.028 -179.836 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 13.2 p -133.17 140.97 45.9 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.634 0 C-N-CA 125.76 1.624 . . . . 0.0 108.916 171.943 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 35.4 mtmt -58.48 137.85 57.08 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 121.284 -0.885 . . . . 0.0 111.16 176.35 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -60.36 -41.76 94.39 Favored 'General case' 0 C--O 1.22 -0.45 0 CA-C-O 118.9 -0.571 . . . . 0.0 110.707 174.661 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 32.1 t -67.91 -20.18 65.07 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 119.151 0.887 . . . . 0.0 113.062 177.24 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 33.8 m-20 -78.57 -44.92 22.99 Favored 'General case' 0 CA--C 1.541 0.63 0 O-C-N 120.642 -1.287 . . . . 0.0 114.351 168.554 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 66.0 t-105 -72.63 -33.84 66.91 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 125.907 1.683 . . . . 0.0 113.618 177.898 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 44.3 t-20 -71.79 -21.64 61.69 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 127.063 2.145 . . . . 0.0 111.848 172.628 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 75.4 mt-30 -91.2 1.19 57.28 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.972 1.309 . . . . 0.0 113.544 164.97 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 93.4 m-70 59.68 28.75 18.24 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 126.782 2.033 . . . . 0.0 114.854 170.484 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 75.0 mttt -68.34 163.28 23.42 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 126.144 1.778 . . . . 0.0 111.855 179.245 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 4.8 pm0 -54.72 111.44 0.81 Allowed 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 113.653 0.983 . . . . 0.0 113.653 -175.143 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 50.5 tp -64.0 -34.71 78.63 Favored 'General case' 0 N--CA 1.469 0.504 0 O-C-N 120.659 -1.276 . . . . 0.0 111.223 -169.444 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 32.5 mp0 -72.86 -17.55 61.52 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 125.545 1.538 . . . . 0.0 113.737 -174.415 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 50.1 mmtt -118.91 -25.09 6.37 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 125.334 1.454 . . . . 0.0 114.256 179.223 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 98.0 m -71.32 -33.0 69.27 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 118.526 0.603 . . . . 0.0 112.128 169.211 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 15.1 ptp180 -63.25 165.14 7.77 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-O 121.888 0.851 . . . . 0.0 112.886 173.761 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -178.12 178.63 48.56 Favored Glycine 0 CA--C 1.523 0.531 0 CA-C-N 115.034 -0.985 . . . . 0.0 112.593 171.799 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 27.5 m -93.66 141.48 14.73 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.461 0 C-N-CA 123.758 0.823 . . . . 0.0 110.697 167.293 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 43.8 p90 -134.04 154.48 80.24 Favored Pre-proline 0 C--O 1.24 0.563 0 C-N-CA 124.997 1.319 . . . . 0.0 112.371 175.415 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -68.44 112.48 2.83 Favored 'Trans proline' 0 N--CA 1.459 -0.53 0 C-N-CA 121.86 1.707 . . . . 0.0 109.214 172.398 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 19.5 pt-20 -56.87 -26.98 59.82 Favored 'General case' 0 N--CA 1.476 0.844 0 O-C-N 121.252 -0.905 . . . . 0.0 112.428 -176.979 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 6.7 p-10 -64.81 -23.73 67.33 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 125.782 1.633 . . . . 0.0 113.594 177.023 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 23.0 m-85 -69.86 -11.63 61.01 Favored 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 117.074 2.25 . . . . 0.0 117.074 166.577 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 589' ' ' THR . . . . . 0.485 HG22 ' HA ' ' A' ' 527' ' ' ALA . 71.5 p -128.53 174.59 9.24 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 125.603 1.561 . . . . 0.0 110.546 -176.391 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -134.37 145.81 49.32 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 123.612 0.765 . . . . 0.0 110.711 169.596 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -58.83 135.14 57.42 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 124.959 1.303 . . . . 0.0 110.804 175.542 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 592' ' ' VAL . . . . . 0.484 HG23 ' HB2' ' A' ' 524' ' ' LYS . 3.1 m -123.35 155.68 64.84 Favored Pre-proline 0 CA--C 1.544 0.745 0 C-N-CA 126.013 1.725 . . . . 0.0 107.762 173.851 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 593' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo . . . . . 0 C--O 1.251 1.15 0 C-N-CA 123.62 2.88 . . . . 0.0 114.976 -169.406 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B 1728 ' ' SER . . . . . . . . . . . . . 30.6 t . . . . . 0 N--CA 1.474 0.73 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B 1729 ' ' THR . . . . . . . . . . . . 0.255 0.2 OUTLIER -133.31 -2.84 3.09 Favored 'General case' 0 N--CA 1.48 1.051 0 N-CA-C 117.486 2.402 . . . . 0.0 117.486 -156.844 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B 1730 ' ' VAL . . . . . . . . . . . . . 16.9 m -141.06 133.88 14.36 Favored Pre-proline 0 CA--C 1.543 0.685 0 C-N-CA 125.827 1.651 . . . . 0.0 108.844 162.365 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -70.3 173.98 10.65 Favored 'Trans proline' 0 CA--C 1.54 0.798 0 C-N-CA 123.732 2.955 . . . . 0.0 113.511 179.432 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 7.1 t -134.26 129.54 53.49 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 C-N-CA 125.796 1.638 . . . . 0.0 112.123 -176.53 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -69.55 133.79 88.78 Favored Pre-proline 0 CA--C 1.555 1.161 0 O-C-N 121.558 -0.714 . . . . 0.0 112.596 -177.04 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -80.05 164.06 22.55 Favored 'Trans proline' 0 CA--C 1.547 1.161 0 C-N-CA 123.274 2.649 . . . . 0.0 113.353 -177.888 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 77.1 Cg_exo -56.21 149.45 54.51 Favored 'Trans proline' 0 CA--C 1.54 0.79 0 C-N-CA 123.716 2.944 . . . . 0.0 114.907 -178.764 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B 1736 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -129.02 169.84 14.21 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 125.876 1.67 . . . . 0.0 111.566 177.499 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B 1737 ' ' ARG . . . . . . . . . . . . . 75.9 mtp85 -118.38 171.89 7.84 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 125.66 1.584 . . . . 0.0 114.0 -169.896 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B 1738 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.17 158.66 34.85 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 124.183 0.993 . . . . 0.0 113.433 -179.604 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B 1739 ' ' ARG . . . . . . . . . . . . . 5.4 tpp180 -147.48 149.92 33.59 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 124.321 1.048 . . . . 0.0 113.664 -162.971 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B 1740 ' ' GLY . . . . . . . . . . . . . . . 74.72 165.22 13.19 Favored Glycine 0 CA--C 1.534 1.245 0 N-CA-C 116.942 1.537 . . . . 0.0 116.942 157.23 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B 1741 ' ' ARG . . . . . . . . . . . . . 7.6 tpp85 -149.38 35.3 0.72 Allowed 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 125.266 1.426 . . . . 0.0 112.376 176.708 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B 1742 ' ' ASN . . . . . . . . . . . . . 21.5 p30 -77.7 5.99 8.26 Favored 'General case' 0 CA--C 1.553 1.064 0 N-CA-C 116.559 2.059 . . . . 0.0 116.559 -172.593 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B 1743 ' ' LEU . . . . . . . . . . . . . 1.4 pt? -61.48 149.4 38.84 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 119.55 1.068 . . . . 0.0 113.57 172.848 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B 1744 ' ' THR . . . . . . . . . . . . 0.277 0.2 OUTLIER . . . . . 0 C--O 1.252 1.21 0 N-CA-C 117.979 2.585 . . . . 0.0 117.979 -173.918 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 513' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.391 0 N-CA-C 111.996 -0.442 . . . . 0.0 111.996 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 514' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -100.58 152.48 20.37 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 126.634 1.974 . . . . 0.0 112.194 177.103 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 65.8 mt -99.43 -24.42 14.8 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.293 1.037 . . . . 0.0 113.395 177.909 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 516' ' ' ASP . . . . . . . . . . . . . 46.3 p-10 -150.34 179.41 8.15 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.253 1.421 . . . . 0.0 113.689 -173.097 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 517' ' ' LEU . . . . . 0.448 HD22 HD22 ' A' ' 548' ' ' LEU . 10.3 mt -107.08 166.37 11.19 Favored Pre-proline 0 CA--C 1.55 0.972 0 C-N-CA 126.839 2.055 . . . . 0.0 111.966 173.649 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -73.15 160.51 45.24 Favored 'Trans proline' 0 CA--C 1.539 0.757 0 C-N-CA 123.677 2.918 . . . . 0.0 113.394 -174.983 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -62.81 135.0 49.66 Favored 'Trans proline' 0 N--CA 1.459 -0.547 0 C-N-CA 123.353 2.702 . . . . 0.0 110.228 178.867 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 76.82 -1.34 62.93 Favored Glycine 0 CA--C 1.534 1.254 0 CA-C-O 117.295 -1.836 . . . . 0.0 115.508 -178.139 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 49.0 t80 -41.29 131.69 2.73 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 120.683 2.241 . . . . 0.0 115.741 -177.317 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 65.6 mtm -105.52 -56.27 2.2 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 123.269 0.628 . . . . 0.0 111.595 179.547 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 523' ' ' PHE . . . . . . . . . . . . . 21.9 p90 -161.33 168.24 24.31 Favored 'General case' 0 C--O 1.224 -0.239 0 C-N-CA 125.88 1.672 . . . . 0.0 113.35 -173.417 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 524' ' ' LYS . . . . . 0.545 ' HE2' ' CD2' ' A' ' 548' ' ' LEU . 41.9 mttt -98.44 163.58 12.63 Favored 'General case' 0 N--CA 1.469 0.506 0 O-C-N 121.223 -0.923 . . . . 0.0 112.155 165.371 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 13.7 m -133.91 158.48 42.41 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 C-N-CA 126.706 2.002 . . . . 0.0 109.171 164.228 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 54.8 tt0 -122.0 131.57 54.07 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 119.12 0.873 . . . . 0.0 112.034 170.701 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 527' ' ' ALA . . . . . 0.449 ' HA ' HG22 ' A' ' 589' ' ' THR . . . -64.15 125.38 24.34 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 121.115 -0.991 . . . . 0.0 112.68 179.166 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 58.8 mm-40 -89.54 -23.94 21.88 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 125.791 1.636 . . . . 0.0 112.024 174.04 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 96.6 m-70 -141.28 162.53 35.27 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 126.768 2.027 . . . . 0.0 110.699 -175.323 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -80.67 128.1 33.24 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 125.68 1.592 . . . . 0.0 113.825 176.782 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 86.2 t80 -129.27 115.67 17.97 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.521 1.129 . . . . 0.0 113.933 179.18 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -79.36 121.84 25.63 Favored 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 116.139 1.904 . . . . 0.0 116.139 175.365 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -71.33 124.49 24.67 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 118.723 0.692 . . . . 0.0 111.455 175.533 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 9.8 t -129.41 37.93 3.94 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 127.095 2.158 . . . . 0.0 110.089 -177.399 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 18.6 t0 -161.78 158.2 25.35 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.804 1.642 . . . . 0.0 107.67 166.211 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 3.1 t -62.73 -21.32 65.71 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 114.982 1.475 . . . . 0.0 114.982 164.539 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 29.0 t0 -74.95 -30.07 61.12 Favored 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 125.343 1.457 . . . . 0.0 110.364 173.969 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 67.7 mt-10 -84.64 154.74 22.35 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 115.515 1.672 . . . . 0.0 115.515 -164.872 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -102.88 134.04 46.96 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 127.449 2.3 . . . . 0.0 110.217 174.118 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 29.5 tt0 -87.63 128.72 35.27 Favored 'General case' 0 CA--C 1.537 0.457 0 O-C-N 121.483 -0.761 . . . . 0.0 110.965 174.661 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 78.2 mt -120.82 146.76 46.2 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 123.971 0.908 . . . . 0.0 111.088 178.53 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 7.3 tmtm? -121.86 144.94 48.54 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 125.447 1.499 . . . . 0.0 108.693 170.47 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -55.24 109.81 0.59 Allowed 'General case' 0 CA--C 1.548 0.871 0 CA-C-O 121.601 0.715 . . . . 0.0 111.622 -177.74 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 118.1 -11.13 13.24 Favored Glycine 0 CA--C 1.534 1.242 0 C-N-CA 126.857 2.17 . . . . 0.0 114.652 -175.539 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 85.9 m-20 -70.38 120.17 15.64 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 119.604 1.702 . . . . 0.0 114.017 -173.795 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 1.8 t -72.39 135.6 27.45 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.088 0 CA-C-N 119.051 0.841 . . . . 0.0 112.547 167.22 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 1.1 t -126.93 122.49 60.49 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.455 0 C-N-CA 126.236 1.814 . . . . 0.0 111.708 177.635 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 548' ' ' LEU . . . . . 0.545 ' CD2' ' HE2' ' A' ' 524' ' ' LYS . 19.1 mt -77.92 101.45 6.84 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 124.845 1.258 . . . . 0.0 108.787 174.548 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 549' ' ' VAL . . . . . . . . . . . . . 5.0 t -63.6 131.42 29.16 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.076 0 N-CA-C 114.252 1.204 . . . . 0.0 114.252 173.497 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 3.8 pt -130.51 154.53 81.65 Favored Pre-proline 0 CA--C 1.547 0.854 0 C-N-CA 127.027 2.131 . . . . 0.0 109.318 177.3 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo -71.9 143.85 41.92 Favored 'Trans proline' 0 CA--C 1.536 0.62 0 C-N-CA 123.442 2.762 . . . . 0.0 110.989 174.983 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 19.3 m-85 -56.52 153.1 10.61 Favored 'General case' 0 N--CA 1.466 0.344 0 N-CA-C 117.739 2.496 . . . . 0.0 117.739 -170.604 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 553' ' ' GLN . . . . . . . . . . . . . 7.4 pt20 -61.65 -29.77 70.28 Favored 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 113.827 1.047 . . . . 0.0 113.827 175.134 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 9.7 m-20 -156.81 154.96 27.76 Favored Pre-proline 0 CA--C 1.545 0.779 0 CA-C-N 119.51 1.05 . . . . 0.0 113.024 173.374 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 555' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -71.65 -29.06 16.48 Favored 'Trans proline' 0 CA--C 1.54 0.82 0 C-N-CA 123.932 3.088 . . . . 0.0 113.364 178.055 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 26.0 pt-20 -72.71 -26.13 61.48 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 124.04 0.936 . . . . 0.0 112.145 170.146 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 557' ' ' GLU . . . . . . . . . . . . . 34.6 mm-40 -78.94 -28.92 43.81 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 125.657 1.583 . . . . 0.0 114.603 178.3 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 38.3 tt0 -67.13 127.67 33.49 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 123.311 0.645 . . . . 0.0 112.685 -175.17 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -101.06 144.92 29.4 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 124.673 1.189 . . . . 0.0 108.496 -173.583 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 43.0 tp10 -73.64 124.36 25.8 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.407 1.083 . . . . 0.0 111.787 -174.694 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 82.01 2.07 90.47 Favored Glycine 0 CA--C 1.54 1.646 0 C-N-CA 124.374 0.987 . . . . 0.0 115.273 -175.844 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 45.2 m95 -97.9 165.98 11.67 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 126.132 1.773 . . . . 0.0 113.427 176.3 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 14.7 mt -133.46 161.28 34.98 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 124.702 1.201 . . . . 0.0 110.654 168.239 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 50.6 ttm -119.29 144.51 46.76 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 125.362 1.465 . . . . 0.0 111.52 176.21 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -173.68 -173.43 39.88 Favored Glycine 0 CA--C 1.527 0.801 0 C-N-CA 124.275 0.941 . . . . 0.0 113.399 177.384 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 13.9 p -130.92 141.73 45.42 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 C-N-CA 126.265 1.826 . . . . 0.0 108.907 172.76 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 26.7 mtmt -61.35 139.44 58.18 Favored 'General case' 0 N--CA 1.468 0.459 0 O-C-N 120.867 -1.146 . . . . 0.0 111.771 177.9 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 20.8 tt0 -61.77 -42.31 98.82 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-O 118.288 -0.863 . . . . 0.0 111.17 178.639 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 24.6 t -65.43 -30.55 71.36 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-N 119.36 0.982 . . . . 0.0 112.61 177.041 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 89.0 m-20 -67.28 -43.58 81.41 Favored 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 114.555 1.317 . . . . 0.0 114.555 171.691 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 64.3 t-105 -71.91 -26.69 62.41 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.885 1.274 . . . . 0.0 113.285 172.694 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 7.3 t-20 -74.47 -31.15 62.13 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.862 1.665 . . . . 0.0 111.093 171.792 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 64.5 mm-40 -77.41 -7.08 55.57 Favored 'General case' 0 N--CA 1.477 0.894 0 CA-C-N 119.09 0.859 . . . . 0.0 113.23 166.799 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 12.1 m-70 63.24 32.09 15.1 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 127.284 2.234 . . . . 0.0 112.728 178.335 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 28.6 mttm -63.27 157.29 23.15 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 125.073 1.349 . . . . 0.0 112.649 179.53 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 3.9 pm0 -52.81 101.19 0.04 OUTLIER 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 124.865 1.266 . . . . 0.0 113.055 -179.448 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 26.4 tp -59.08 -47.95 83.39 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 124.165 0.986 . . . . 0.0 111.351 -163.428 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 21.0 mp0 -73.17 -18.55 61.25 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 115.461 -0.791 . . . . 0.0 112.098 -168.377 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 57.3 tptt -95.56 -36.02 11.43 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 124.69 1.196 . . . . 0.0 112.92 170.022 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 6.3 t -77.9 -22.27 49.95 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 124.112 0.965 . . . . 0.0 112.901 -174.164 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 32.0 ptt180 -64.26 163.11 13.42 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.802 1.241 . . . . 0.0 112.327 171.94 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -170.56 173.65 44.43 Favored Glycine 0 CA--C 1.526 0.769 0 C-N-CA 123.874 0.749 . . . . 0.0 113.95 175.654 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 19.5 m -91.55 144.16 9.78 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 C-N-CA 124.641 1.176 . . . . 0.0 112.064 170.704 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 47.5 p90 -140.9 153.74 67.8 Favored Pre-proline 0 CA--C 1.543 0.684 0 C-N-CA 124.782 1.233 . . . . 0.0 113.202 177.094 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -65.79 112.16 2.13 Favored 'Trans proline' 0 C--N 1.347 0.484 0 C-N-CA 122.195 1.93 . . . . 0.0 109.543 169.906 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 21.9 pt-20 -54.37 -31.14 54.0 Favored 'General case' 0 N--CA 1.473 0.721 0 O-C-N 121.735 -0.603 . . . . 0.0 112.243 -178.388 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 9.7 p-10 -68.46 -17.36 64.17 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 126.642 1.977 . . . . 0.0 114.318 -179.86 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 19.4 m-85 -72.13 -11.08 60.58 Favored 'General case' 0 CA--C 1.534 0.365 0 N-CA-C 116.269 1.951 . . . . 0.0 116.269 164.369 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 589' ' ' THR . . . . . 0.449 HG22 ' HA ' ' A' ' 527' ' ' ALA . 71.5 p -129.85 166.42 20.0 Favored 'General case' 0 C--O 1.234 0.237 0 C-N-CA 125.809 1.644 . . . . 0.0 112.037 -173.999 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -122.93 134.34 54.36 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 123.547 0.739 . . . . 0.0 110.377 176.941 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.84 123.93 21.92 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 125.808 1.643 . . . . 0.0 109.555 -177.548 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 592' ' ' VAL . . . . . . . . . . . . . 6.9 m -113.76 153.4 45.98 Favored Pre-proline 0 CA--C 1.552 1.034 0 C-N-CA 124.854 1.262 . . . . 0.0 109.306 -177.211 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 593' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_endo . . . . . 0 C--O 1.253 1.264 0 C-N-CA 125.29 3.994 . . . . 0.0 115.532 -169.835 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B 1728 ' ' SER . . . . . . . . . . . . . 35.9 p . . . . . 0 N--CA 1.472 0.632 0 CA-C-O 119.374 -0.346 . . . . 0.0 111.23 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B 1729 ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -81.92 -29.05 32.48 Favored 'General case' 0 N--CA 1.477 0.917 0 N-CA-C 117.095 2.257 . . . . 0.0 117.095 -176.793 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B 1730 ' ' VAL . . . . . . . . . . . . . 12.7 m -77.14 151.09 81.31 Favored Pre-proline 0 N--CA 1.476 0.843 0 C-N-CA 124.463 1.105 . . . . 0.0 113.159 -177.491 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 70.5 Cg_endo -68.49 175.46 6.96 Favored 'Trans proline' 0 CA--C 1.543 0.931 0 C-N-CA 123.233 2.622 . . . . 0.0 113.405 169.857 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 15.6 t -124.75 137.88 55.96 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 C-N-CA 125.159 1.384 . . . . 0.0 111.924 175.476 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -68.44 143.27 95.28 Favored Pre-proline 0 CA--C 1.554 1.112 0 O-C-N 121.537 -0.727 . . . . 0.0 112.631 179.086 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 26.6 Cg_endo -76.87 164.52 29.84 Favored 'Trans proline' 0 CA--C 1.548 1.2 0 C-N-CA 122.893 2.395 . . . . 0.0 113.51 177.221 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -70.28 139.19 37.85 Favored 'Trans proline' 0 CA--C 1.541 0.849 0 C-N-CA 123.455 2.77 . . . . 0.0 112.131 176.44 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B 1736 ' ' ARG . . . . . . . . . . . . . 23.5 mtp180 -97.74 174.57 6.54 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 126.457 1.903 . . . . 0.0 115.531 -170.71 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B 1737 ' ' ARG . . . . . . . . . . . . . 25.0 mtp85 54.94 79.85 0.14 Allowed 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 127.366 2.266 . . . . 0.0 112.823 172.348 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B 1738 ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -74.4 -26.68 60.24 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 127.56 2.344 . . . . 0.0 114.101 -176.411 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B 1739 ' ' ARG . . . . . . . . . . . . . 10.8 ptt85 -35.89 122.55 0.68 Allowed 'General case' 0 N--CA 1.484 1.243 0 N-CA-C 116.873 2.175 . . . . 0.0 116.873 -169.185 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B 1740 ' ' GLY . . . . . . . . . . . . . . . 172.77 -149.55 11.56 Favored Glycine 0 CA--C 1.534 1.239 0 C-N-CA 125.656 1.598 . . . . 0.0 112.72 -178.557 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B 1741 ' ' ARG . . . . . . . . . . . . . 48.2 ttt-85 -43.55 130.63 5.21 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 126.015 1.726 . . . . 0.0 112.907 174.565 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B 1742 ' ' ASN . . . . . . . . . . . . . 34.4 t30 -76.09 142.54 41.69 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 118.433 0.561 . . . . 0.0 110.987 168.793 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B 1743 ' ' LEU . . . . . . . . . . . . . 4.4 pp -129.21 153.7 47.49 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.529 1.131 . . . . 0.0 112.597 174.461 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B 1744 ' ' THR . . . . . . . . . . . . . 2.3 m . . . . . 0 C--O 1.253 1.27 0 C-N-CA 127.142 2.177 . . . . 0.0 114.24 176.01 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 513' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.784 0 N-CA-C 110.847 -0.901 . . . . 0.0 110.847 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 514' ' ' ARG . . . . . . . . . . . . . 3.8 ppt_? -63.62 165.37 8.26 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 126.879 2.071 . . . . 0.0 114.044 -179.388 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 88.6 mt -104.65 -56.28 2.21 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 126.18 1.792 . . . . 0.0 110.058 163.99 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 516' ' ' ASP . . . . . . . . . . . . . 61.3 m-20 -97.59 146.47 25.26 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 117.033 2.235 . . . . 0.0 117.033 -176.497 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 517' ' ' LEU . . . . . 0.474 HD22 HD22 ' A' ' 548' ' ' LEU . 11.7 mt -79.14 163.91 57.41 Favored Pre-proline 0 CA--C 1.553 1.093 0 C-N-CA 124.451 1.101 . . . . 0.0 111.069 161.153 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -67.97 160.07 50.15 Favored 'Trans proline' 0 CA--C 1.541 0.842 0 C-N-CA 123.671 2.914 . . . . 0.0 113.222 -177.078 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -62.61 134.15 46.12 Favored 'Trans proline' 0 CA--C 1.535 0.562 0 C-N-CA 123.05 2.5 . . . . 0.0 111.037 -177.598 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 74.42 -2.1 47.7 Favored Glycine 0 CA--C 1.535 1.337 0 CA-C-O 117.628 -1.651 . . . . 0.0 115.751 -178.675 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 31.3 t80 -31.69 123.7 0.27 Allowed 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 117.827 2.528 . . . . 0.0 117.827 -176.795 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 46.2 mtm -94.81 -53.1 3.98 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 112.413 0.523 . . . . 0.0 112.413 -176.095 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 523' ' ' PHE . . . . . 0.402 ' CE2' HG21 ' A' ' 549' ' ' VAL . 28.1 p90 -169.55 174.26 5.99 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 126.556 1.943 . . . . 0.0 112.872 -173.591 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 524' ' ' LYS . . . . . 0.451 ' HG2' HD23 ' A' ' 548' ' ' LEU . 50.9 mttt -106.58 163.81 12.58 Favored 'General case' 0 N--CA 1.47 0.543 0 O-C-N 120.818 -1.176 . . . . 0.0 112.653 169.207 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 12.5 m -133.3 160.91 42.16 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.925 0 C-N-CA 126.626 1.97 . . . . 0.0 110.065 165.413 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 25.6 tt0 -124.5 127.37 47.35 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 119.709 1.14 . . . . 0.0 112.919 172.733 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 527' ' ' ALA . . . . . 0.492 ' HA ' HG22 ' A' ' 589' ' ' THR . . . -64.6 123.71 19.98 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.618 1.167 . . . . 0.0 112.738 -178.45 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 35.5 mm-40 -89.68 -25.35 21.27 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 125.426 1.49 . . . . 0.0 111.87 175.276 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 94.3 m-70 -138.62 164.66 28.91 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 127.745 2.418 . . . . 0.0 110.121 179.915 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -87.73 138.64 31.29 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 107.092 -1.447 . . . . 0.0 107.092 177.098 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 66.9 t80 -127.43 115.74 19.38 Favored 'General case' 0 C--N 1.332 -0.187 0 C-N-CA 125.586 1.555 . . . . 0.0 113.648 -179.194 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -84.15 128.45 34.57 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 114.722 1.379 . . . . 0.0 114.722 -177.56 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -72.11 108.64 5.41 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 121.778 0.799 . . . . 0.0 111.139 -179.309 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 12.3 t -80.53 -17.97 49.91 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 114.388 1.255 . . . . 0.0 114.388 -177.991 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 24.8 m-20 -148.57 168.84 21.71 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 127.205 2.202 . . . . 0.0 114.9 -171.262 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 2.0 t -61.06 -34.78 75.43 Favored 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 117.012 2.227 . . . . 0.0 117.012 -173.284 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 45.3 m-20 -81.34 -15.21 56.04 Favored 'General case' 0 CA--C 1.539 0.558 0 N-CA-C 114.971 1.471 . . . . 0.0 114.971 177.643 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 24.3 mp0 -83.71 134.37 34.76 Favored 'General case' 0 CA--C 1.543 0.707 0 O-C-N 120.873 -1.142 . . . . 0.0 113.849 -166.412 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -83.9 128.63 34.68 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.922 1.689 . . . . 0.0 110.442 178.93 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 8.6 tt0 -90.1 132.41 35.44 Favored 'General case' 0 CA--C 1.537 0.48 0 O-C-N 121.667 -0.645 . . . . 0.0 111.932 177.827 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 73.1 mt -123.68 146.43 48.24 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.722 1.209 . . . . 0.0 112.643 -174.741 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -114.3 141.17 47.93 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 125.05 1.34 . . . . 0.0 110.126 170.272 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -56.2 104.91 0.16 Allowed 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 123.75 0.82 . . . . 0.0 111.895 179.622 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 125.38 -12.74 7.48 Favored Glycine 0 CA--C 1.532 1.147 0 C-N-CA 126.616 2.055 . . . . 0.0 114.296 -174.161 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 90.0 m-20 -74.14 125.43 28.33 Favored 'General case' 0 C--O 1.231 0.12 0 N-CA-C 115.227 1.565 . . . . 0.0 115.227 -173.183 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 2.6 t -73.85 134.33 29.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 C-N-CA 122.921 0.488 . . . . 0.0 111.394 167.041 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 1.4 t -121.92 121.6 64.59 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.593 0 C-N-CA 124.9 1.28 . . . . 0.0 111.308 174.108 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 548' ' ' LEU . . . . . 0.474 HD22 HD22 ' A' ' 517' ' ' LEU . 18.3 mt -77.17 100.22 5.7 Favored 'General case' 0 CA--C 1.539 0.525 0 N-CA-C 108.055 -1.091 . . . . 0.0 108.055 175.895 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 549' ' ' VAL . . . . . 0.402 HG21 ' CE2' ' A' ' 523' ' ' PHE . 4.1 t -62.03 129.31 24.96 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.92 0 N-CA-C 113.652 0.982 . . . . 0.0 113.652 171.572 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 8.3 pt -123.69 154.67 66.9 Favored Pre-proline 0 CA--C 1.54 0.592 0 C-N-CA 125.965 1.706 . . . . 0.0 109.447 179.581 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -65.39 142.28 71.71 Favored 'Trans proline' 0 N--CA 1.458 -0.593 0 C-N-CA 122.711 2.274 . . . . 0.0 110.026 174.686 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 34.5 m-85 -58.33 140.0 54.26 Favored 'General case' 0 C--O 1.235 0.335 0 N-CA-C 116.807 2.151 . . . . 0.0 116.807 -175.555 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 553' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -61.12 -27.69 68.57 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 114.6 1.333 . . . . 0.0 114.6 178.093 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 6.4 m-20 -156.73 153.15 23.85 Favored Pre-proline 0 CA--C 1.542 0.652 0 C-N-CA 125.876 1.67 . . . . 0.0 111.73 174.225 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 555' ' ' PRO . . . . . . . . . . . . . 62.8 Cg_endo -68.09 -33.25 25.81 Favored 'Trans proline' 0 CA--C 1.537 0.637 0 C-N-CA 123.592 2.861 . . . . 0.0 112.761 -177.326 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 26.5 pt-20 -76.71 -16.96 59.37 Favored 'General case' 0 CA--C 1.544 0.713 0 O-C-N 121.393 -0.817 . . . . 0.0 113.074 174.053 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 557' ' ' GLU . . . . . . . . . . . . . 55.4 mm-40 -78.94 -17.75 54.97 Favored 'General case' 0 CA--C 1.545 0.766 0 O-C-N 121.165 -0.96 . . . . 0.0 113.005 176.167 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 49.1 tt0 -76.79 129.22 35.97 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 125.299 1.44 . . . . 0.0 111.988 174.694 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -114.73 149.77 36.34 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 126.189 1.795 . . . . 0.0 113.083 171.517 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 57.0 tt0 -69.9 122.99 20.37 Favored 'General case' 0 CA--C 1.538 0.49 0 O-C-N 121.142 -0.974 . . . . 0.0 111.436 -173.493 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 85.43 -2.23 88.13 Favored Glycine 0 CA--C 1.535 1.343 0 C-N-CA 125.059 1.314 . . . . 0.0 115.059 -176.519 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 59.1 m95 -95.08 154.1 17.34 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 126.025 1.73 . . . . 0.0 112.643 174.008 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 13.1 mt -131.04 159.73 36.68 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 123.18 0.592 . . . . 0.0 111.161 168.967 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 48.3 ttm -117.27 139.55 50.67 Favored 'General case' 0 CA--C 1.527 0.091 0 C-N-CA 125.384 1.474 . . . . 0.0 110.712 -179.668 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -170.37 -175.75 39.39 Favored Glycine 0 CA--C 1.523 0.584 0 C-N-CA 123.943 0.783 . . . . 0.0 112.49 -178.896 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 14.9 p -128.04 138.82 53.61 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.444 0 C-N-CA 125.406 1.482 . . . . 0.0 108.578 169.526 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 38.7 mtmt -58.09 134.43 56.43 Favored 'General case' 0 N--CA 1.465 0.307 0 O-C-N 121.377 -0.827 . . . . 0.0 110.559 176.198 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -58.92 -42.99 91.0 Favored 'General case' 0 C--O 1.22 -0.469 0 CA-C-O 118.773 -0.632 . . . . 0.0 109.749 175.552 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 57.4 p -60.0 -22.59 62.77 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 115.508 1.67 . . . . 0.0 115.508 174.074 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 53.9 m-20 -85.13 -45.31 12.19 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.962 1.305 . . . . 0.0 114.219 173.862 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 59.4 t-105 -67.57 -35.86 79.84 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.323 1.449 . . . . 0.0 112.826 174.857 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 9.7 t-20 -77.7 -14.44 59.61 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 126.21 1.804 . . . . 0.0 112.852 175.971 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 57.4 mm-40 -90.81 0.46 57.45 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 125.198 1.399 . . . . 0.0 112.666 162.106 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 93.6 m-70 59.58 34.85 22.46 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 127.871 2.468 . . . . 0.0 114.044 175.894 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 6.6 mtpm? -74.45 147.78 41.68 Favored 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 125.217 1.407 . . . . 0.0 110.659 177.806 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 6.7 pm0 -51.94 103.58 0.07 Allowed 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 126.585 1.954 . . . . 0.0 114.505 -175.397 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 57.5 tp -51.38 -49.63 61.14 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 126.236 1.814 . . . . 0.0 113.27 -171.713 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 92.6 mt-10 -66.02 -13.43 59.91 Favored 'General case' 0 CA--C 1.546 0.805 0 N-CA-C 114.154 1.168 . . . . 0.0 114.154 -175.757 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 33.5 mmtp -106.7 -30.13 9.16 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 125.381 1.472 . . . . 0.0 112.963 171.818 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 84.0 m -82.9 -23.04 33.75 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 114.221 1.193 . . . . 0.0 114.221 -176.965 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 40.3 ptt180 -63.64 162.61 12.77 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.907 1.283 . . . . 0.0 112.753 173.287 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -175.43 176.21 47.31 Favored Glycine 0 CA--C 1.529 0.929 0 CA-C-N 115.282 -0.872 . . . . 0.0 115.132 170.525 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 34.1 m -93.36 140.88 15.61 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 C-N-CA 124.819 1.247 . . . . 0.0 112.242 169.482 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 50.8 p90 -140.37 155.92 69.88 Favored Pre-proline 0 CA--C 1.544 0.721 0 C-N-CA 125.259 1.423 . . . . 0.0 112.484 176.738 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_endo -71.11 112.37 3.29 Favored 'Trans proline' 0 CA--C 1.533 0.467 0 C-N-CA 122.535 2.157 . . . . 0.0 109.667 171.158 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 20.2 pt-20 -57.56 -26.06 60.88 Favored 'General case' 0 N--CA 1.476 0.871 0 O-C-N 121.286 -0.884 . . . . 0.0 112.441 179.906 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 10.1 p-10 -71.75 -10.72 60.19 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 125.683 1.593 . . . . 0.0 114.859 177.268 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 18.6 m-85 -75.65 -13.83 60.34 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 117.003 2.223 . . . . 0.0 117.003 160.051 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 589' ' ' THR . . . . . 0.492 HG22 ' HA ' ' A' ' 527' ' ' ALA . 73.4 p -122.13 175.8 6.17 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 126.339 1.856 . . . . 0.0 110.477 -175.91 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -124.59 137.78 54.37 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 124.145 0.978 . . . . 0.0 108.803 170.003 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.67 125.56 27.78 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 123.742 0.817 . . . . 0.0 109.151 179.666 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 592' ' ' VAL . . . . . . . . . . . . . 7.1 m -112.22 156.61 41.76 Favored Pre-proline 0 N--CA 1.479 1.022 0 C-N-CA 124.911 1.284 . . . . 0.0 109.774 -175.586 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 593' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo . . . . . 0 C--O 1.252 1.214 0 C-N-CA 124.508 3.472 . . . . 0.0 113.437 -175.196 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B 1728 ' ' SER . . . . . . . . . . . . . 41.6 p . . . . . 0 N--CA 1.475 0.806 0 CA-C-O 120.786 0.327 . . . . 0.0 111.0 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B 1729 ' ' THR . . . . . . . . . . . . . 15.0 t -105.25 -17.75 14.36 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 125.847 1.659 . . . . 0.0 114.446 -175.73 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B 1730 ' ' VAL . . . . . . . . . . . . . 22.1 m -68.78 150.15 97.71 Favored Pre-proline 0 N--CA 1.476 0.838 0 O-C-N 121.512 -0.742 . . . . 0.0 112.247 174.221 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -69.16 166.32 27.27 Favored 'Trans proline' 0 CA--C 1.54 0.8 0 C-N-CA 123.44 2.76 . . . . 0.0 112.784 171.263 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 4.1 t -135.44 135.14 51.97 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 C-N-CA 124.978 1.311 . . . . 0.0 112.83 178.631 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -61.62 136.63 94.69 Favored Pre-proline 0 CA--C 1.554 1.127 0 O-C-N 121.636 -0.665 . . . . 0.0 112.253 178.321 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -71.52 168.08 24.58 Favored 'Trans proline' 0 CA--C 1.543 0.972 0 C-N-CA 123.305 2.67 . . . . 0.0 111.586 171.712 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -63.94 165.48 18.81 Favored 'Trans proline' 0 CA--C 1.542 0.889 0 C-N-CA 122.739 2.293 . . . . 0.0 113.211 -179.564 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B 1736 ' ' ARG . . . . . . . . . . . . . 10.7 mtm180 -142.83 171.68 13.72 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 127.696 2.398 . . . . 0.0 107.168 178.635 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B 1737 ' ' ARG . . . . . . . . . . . . . 22.4 ptt-85 -146.77 159.47 43.46 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 113.461 0.912 . . . . 0.0 113.461 -174.477 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B 1738 ' ' ARG . . . . . . . . . . . . . 6.0 tpp180 -74.97 131.04 40.37 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 125.573 1.549 . . . . 0.0 111.723 -176.009 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B 1739 ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -80.62 151.5 28.99 Favored 'General case' 0 N--CA 1.477 0.92 0 N-CA-C 114.255 1.205 . . . . 0.0 114.255 -178.366 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B 1740 ' ' GLY . . . . . . . . . . . . . . . -57.14 -30.09 60.45 Favored Glycine 0 CA--C 1.536 1.368 0 C-N-CA 125.834 1.683 . . . . 0.0 117.104 -166.405 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B 1741 ' ' ARG . . . . . . . . . . . . . 3.2 mmp_? -57.21 -4.88 0.23 Allowed 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 125.828 1.651 . . . . 0.0 115.146 171.37 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B 1742 ' ' ASN . . . . . . . . . . . . . 20.5 t-20 -59.29 -11.19 3.74 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 126.727 2.011 . . . . 0.0 115.72 163.592 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B 1743 ' ' LEU . . . . . . . . . . . . . 1.3 pt? -64.7 165.13 10.85 Favored 'General case' 0 CA--C 1.549 0.927 0 CA-C-N 119.667 1.121 . . . . 0.0 113.787 174.051 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B 1744 ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.252 1.205 0 N-CA-C 118.911 2.93 . . . . 0.0 118.911 -173.889 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 513' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.925 0 N-CA-C 110.386 -1.086 . . . . 0.0 110.386 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 514' ' ' ARG . . . . . . . . . . . . . 3.3 ppt_? -88.15 166.06 14.66 Favored 'General case' 0 N--CA 1.476 0.859 0 N-CA-C 114.264 1.209 . . . . 0.0 114.264 -172.754 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -93.77 -57.99 2.39 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.343 1.057 . . . . 0.0 109.618 165.886 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 516' ' ' ASP . . . . . . . . . . . . . 17.9 p30 -124.47 166.09 16.63 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 117.509 2.411 . . . . 0.0 117.509 -169.519 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 517' ' ' LEU . . . . . 0.418 HD22 HD22 ' A' ' 548' ' ' LEU . 10.5 mt -81.07 161.72 61.96 Favored Pre-proline 0 CA--C 1.551 0.99 0 C-N-CA 125.55 1.54 . . . . 0.0 111.945 160.028 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -69.27 161.35 46.24 Favored 'Trans proline' 0 CA--C 1.537 0.648 0 C-N-CA 124.02 3.146 . . . . 0.0 113.782 -175.643 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 65.8 Cg_endo -61.87 142.06 92.04 Favored 'Trans proline' 0 N--CA 1.458 -0.569 0 C-N-CA 122.732 2.288 . . . . 0.0 110.283 178.139 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 67.37 3.56 26.03 Favored Glycine 0 CA--C 1.533 1.186 0 CA-C-O 117.198 -1.89 . . . . 0.0 116.177 -178.369 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 27.9 t80 -40.56 137.28 1.15 Allowed 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 116.886 2.18 . . . . 0.0 116.886 -178.119 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 57.1 mtm -112.91 -53.87 2.67 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 113.435 0.902 . . . . 0.0 113.435 -174.748 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 523' ' ' PHE . . . . . 0.481 ' CE1' HG21 ' A' ' 549' ' ' VAL . 26.1 p90 -167.36 174.32 8.12 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 126.612 1.965 . . . . 0.0 111.389 -178.205 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 524' ' ' LYS . . . . . 0.483 ' HE2' ' CD2' ' A' ' 548' ' ' LEU . 78.1 mttt -109.41 161.95 14.82 Favored 'General case' 0 N--CA 1.467 0.414 0 O-C-N 121.413 -0.804 . . . . 0.0 111.226 171.759 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 5.6 m -130.23 163.83 34.74 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 C-N-CA 126.261 1.824 . . . . 0.0 110.202 165.411 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 60.8 tt0 -129.52 130.81 46.26 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 118.836 0.744 . . . . 0.0 112.694 169.586 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 527' ' ' ALA . . . . . 0.529 ' HA ' HG22 ' A' ' 589' ' ' THR . . . -64.07 119.14 9.58 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.604 1.162 . . . . 0.0 112.335 -178.06 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 46.9 mm-40 -86.13 -22.23 27.18 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.229 1.411 . . . . 0.0 111.417 171.762 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 89.1 m-70 -140.87 157.69 45.02 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 126.404 1.882 . . . . 0.0 110.455 178.033 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -84.77 141.79 30.27 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 -178.656 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 76.9 t80 -136.45 120.7 17.91 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 125.895 1.678 . . . . 0.0 112.306 -179.532 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 1.9 m -90.37 132.78 35.4 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 114.01 1.115 . . . . 0.0 114.01 175.233 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -67.36 128.45 36.44 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-O 121.588 0.709 . . . . 0.0 112.186 -176.655 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 1.7 p -107.19 -3.64 19.62 Favored 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 116.743 2.127 . . . . 0.0 116.743 -177.647 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 34.9 t0 -143.87 165.78 26.77 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 124.799 1.24 . . . . 0.0 108.984 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 1.5 t -55.83 -35.51 66.46 Favored 'General case' 0 N--CA 1.464 0.271 0 N-CA-C 114.673 1.36 . . . . 0.0 114.673 167.081 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 90.2 m-20 -68.06 -22.71 64.93 Favored 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 117.093 2.257 . . . . 0.0 117.093 176.25 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -88.2 144.8 26.24 Favored 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 115.398 1.629 . . . . 0.0 115.398 -163.137 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -90.28 139.89 30.22 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 127.326 2.25 . . . . 0.0 109.82 177.552 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 15.9 tt0 -91.63 131.13 37.25 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.801 0.84 . . . . 0.0 110.559 171.393 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 80.5 mt -124.89 136.94 54.25 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 124.998 1.319 . . . . 0.0 111.961 -179.916 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 3.3 tppp? -96.27 141.72 29.27 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 125.873 1.669 . . . . 0.0 110.495 163.614 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -57.25 107.73 0.45 Allowed 'General case' 0 CA--C 1.545 0.752 0 CA-C-N 119.281 0.946 . . . . 0.0 109.907 170.163 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 122.46 -11.06 9.11 Favored Glycine 0 CA--C 1.537 1.437 0 C-N-CA 126.546 2.022 . . . . 0.0 114.592 -172.191 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 74.6 m-20 -71.85 124.86 25.75 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 119.835 1.818 . . . . 0.0 115.72 -178.029 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 16.7 t -74.89 133.25 31.88 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 C-N-CA 123.232 0.613 . . . . 0.0 110.369 164.382 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -125.48 122.15 61.92 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.443 0 C-N-CA 125.011 1.324 . . . . 0.0 111.136 175.84 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 548' ' ' LEU . . . . . 0.483 ' CD2' ' HE2' ' A' ' 524' ' ' LYS . 20.8 mt -79.93 103.45 9.82 Favored 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 108.149 -1.056 . . . . 0.0 108.149 177.643 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 549' ' ' VAL . . . . . 0.481 HG21 ' CE1' ' A' ' 523' ' ' PHE . 4.0 t -62.32 126.32 20.33 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.083 0 N-CA-C 113.499 0.926 . . . . 0.0 113.499 172.204 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 20.5 pt -126.43 159.8 61.23 Favored Pre-proline 0 N--CA 1.474 0.744 0 C-N-CA 126.978 2.111 . . . . 0.0 108.94 179.219 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo -72.54 149.74 50.14 Favored 'Trans proline' 0 N--CA 1.456 -0.711 0 C-N-CA 122.948 2.432 . . . . 0.0 112.303 175.362 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 72.0 m-85 -64.28 147.53 52.26 Favored 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 113.526 0.936 . . . . 0.0 113.526 167.775 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 553' ' ' GLN . . . . . . . . . . . . . 11.7 pm0 -67.17 -19.89 65.65 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.386 1.475 . . . . 0.0 114.069 170.017 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 7.0 m-20 -151.78 147.13 19.51 Favored Pre-proline 0 CA--C 1.543 0.688 0 C-N-CA 125.447 1.499 . . . . 0.0 112.506 179.883 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 555' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -68.46 -31.53 27.32 Favored 'Trans proline' 0 CA--C 1.535 0.568 0 C-N-CA 124.096 3.197 . . . . 0.0 112.329 175.439 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -77.73 -11.7 59.9 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.756 1.623 . . . . 0.0 114.065 177.467 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 557' ' ' GLU . . . . . . . . . . . . . 23.9 mm-40 -75.0 -33.09 61.78 Favored 'General case' 0 N--CA 1.476 0.868 0 O-C-N 120.986 -1.071 . . . . 0.0 112.721 165.884 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 54.6 tt0 -66.36 128.26 35.48 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 124.373 1.069 . . . . 0.0 112.62 -168.466 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 72.5 m-20 -103.99 145.72 29.74 Favored 'General case' 0 CA--C 1.554 1.135 0 C-N-CA 125.684 1.594 . . . . 0.0 113.066 -176.937 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 72.5 tt0 -76.87 107.53 9.26 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 124.786 1.234 . . . . 0.0 112.938 -169.406 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 96.11 1.29 61.27 Favored Glycine 0 CA--C 1.537 1.419 0 C-N-CA 125.072 1.32 . . . . 0.0 114.392 -174.745 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 53.5 m95 -93.53 169.48 10.31 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 126.344 1.857 . . . . 0.0 113.31 176.67 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 16.6 mt -141.38 153.22 44.95 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 125.488 1.515 . . . . 0.0 110.39 165.787 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 57.5 ttm -105.25 142.52 34.87 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 125.396 1.479 . . . . 0.0 112.262 170.575 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -165.24 -174.83 35.31 Favored Glycine 0 CA--C 1.527 0.788 0 C-N-CA 124.946 1.26 . . . . 0.0 112.795 174.566 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 12.7 p -128.92 139.99 50.43 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 C-N-CA 125.127 1.371 . . . . 0.0 109.321 169.777 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 34.9 mtmt -58.02 135.59 56.99 Favored 'General case' 0 N--CA 1.468 0.435 0 O-C-N 121.538 -0.726 . . . . 0.0 110.814 175.407 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -59.22 -38.88 81.05 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-O 118.159 -0.924 . . . . 0.0 111.215 176.768 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 8.7 t -71.77 -32.65 67.9 Favored 'General case' 0 N--CA 1.477 0.89 0 CA-C-N 119.912 1.233 . . . . 0.0 111.782 -179.175 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 71.2 m-20 -61.59 -50.19 73.62 Favored 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 113.669 0.989 . . . . 0.0 113.669 167.751 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 49.8 t-105 -68.04 -33.36 74.42 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 114.305 1.224 . . . . 0.0 114.305 -179.925 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 8.4 t-20 -68.17 -30.16 69.2 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.591 1.157 . . . . 0.0 111.919 178.292 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 41.6 mt-30 -78.3 3.47 15.42 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.489 1.116 . . . . 0.0 112.984 170.764 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 26.0 m-70 61.15 31.46 19.63 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 126.538 1.935 . . . . 0.0 112.897 179.573 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 20.9 mttm -65.11 154.7 37.15 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 123.883 0.873 . . . . 0.0 112.807 179.819 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 9.1 pm0 -53.18 104.74 0.1 Allowed 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 126.152 1.781 . . . . 0.0 112.892 179.573 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 58.2 tp -64.02 -50.08 69.85 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 124.488 1.115 . . . . 0.0 111.917 -166.299 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 16.1 pm0 -61.39 -22.8 65.31 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.285 1.034 . . . . 0.0 113.778 -178.149 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 23.4 tptm -88.46 -55.27 3.79 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 126.062 1.745 . . . . 0.0 111.195 175.124 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 87.8 m -75.0 -19.63 60.0 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 125.155 1.382 . . . . 0.0 114.694 -168.98 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 19.9 ptt180 -64.03 160.47 17.94 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 123.649 0.78 . . . . 0.0 111.61 170.202 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -166.21 172.33 41.5 Favored Glycine 0 CA--C 1.525 0.709 0 CA-C-N 115.142 -0.936 . . . . 0.0 113.158 173.302 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 22.7 m -91.61 145.53 7.39 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.34 0 C-N-CA 124.427 1.091 . . . . 0.0 111.245 168.853 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 47.4 p90 -140.57 155.5 69.63 Favored Pre-proline 0 C--O 1.24 0.6 0 C-N-CA 124.82 1.248 . . . . 0.0 112.664 176.912 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -67.95 109.41 1.92 Allowed 'Trans proline' 0 N--CA 1.457 -0.623 0 C-N-CA 122.0 1.8 . . . . 0.0 109.62 170.503 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 19.2 pt-20 -54.47 -28.02 41.68 Favored 'General case' 0 N--CA 1.476 0.844 0 O-C-N 121.215 -0.928 . . . . 0.0 112.386 -179.627 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 11.6 p-10 -69.07 -13.59 62.53 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 126.143 1.777 . . . . 0.0 114.361 177.554 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 15.0 m-85 -74.39 -12.83 60.62 Favored 'General case' 0 N--CA 1.467 0.382 0 N-CA-C 116.802 2.149 . . . . 0.0 116.802 163.561 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 589' ' ' THR . . . . . 0.529 HG22 ' HA ' ' A' ' 527' ' ' ALA . 73.4 p -123.99 173.99 7.88 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 125.404 1.482 . . . . 0.0 111.679 -172.93 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -119.89 140.99 50.0 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.746 1.218 . . . . 0.0 108.942 169.726 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 15.0 tpt180 -67.44 105.72 1.9 Allowed 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.496 1.119 . . . . 0.0 108.959 171.545 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 592' ' ' VAL . . . . . 0.445 HG23 ' HB2' ' A' ' 524' ' ' LYS . 2.1 m -83.83 156.65 64.36 Favored Pre-proline 0 CA--C 1.541 0.633 0 C-N-CA 123.637 0.775 . . . . 0.0 109.275 178.963 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 593' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_exo . . . . . 0 C--O 1.255 1.368 1 C-N-CA 126.398 4.732 . . . . 0.0 115.654 172.355 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B 1728 ' ' SER . . . . . . . . . . . . . 3.3 m . . . . . 0 N--CA 1.477 0.886 0 N-CA-C 113.046 0.758 . . . . 0.0 113.046 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B 1729 ' ' THR . . . . . . . . . . . . 0.257 0.2 OUTLIER -118.21 -20.86 8.43 Favored 'General case' 0 N--CA 1.481 1.08 0 N-CA-C 117.166 2.284 . . . . 0.0 117.166 -170.445 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B 1730 ' ' VAL . . . . . . . . . . . . . 12.6 m -69.76 150.27 96.62 Favored Pre-proline 0 N--CA 1.476 0.837 0 C-N-CA 125.119 1.368 . . . . 0.0 112.824 175.556 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -67.46 165.04 28.51 Favored 'Trans proline' 0 CA--C 1.542 0.912 0 C-N-CA 123.947 3.098 . . . . 0.0 114.039 179.896 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 29.7 t -133.85 131.51 56.35 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 125.63 1.572 . . . . 0.0 111.429 -179.622 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -65.62 139.47 97.11 Favored Pre-proline 0 CA--C 1.552 1.039 0 O-C-N 121.439 -0.788 . . . . 0.0 112.361 -179.047 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo -75.13 164.94 32.15 Favored 'Trans proline' 0 CA--C 1.547 1.152 0 C-N-CA 123.186 2.59 . . . . 0.0 112.62 175.709 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -58.55 159.86 18.85 Favored 'Trans proline' 0 CA--C 1.541 0.86 0 C-N-CA 123.67 2.913 . . . . 0.0 114.223 174.888 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B 1736 ' ' ARG . . . . . . . . . . . . . 51.3 mtp180 -127.35 164.24 22.25 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 126.04 1.736 . . . . 0.0 111.715 173.605 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B 1737 ' ' ARG . . . . . . . . . . . . . 35.7 ptt180 -143.47 158.71 43.43 Favored 'General case' 0 N--CA 1.48 1.042 0 N-CA-C 114.529 1.307 . . . . 0.0 114.529 -159.371 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B 1738 ' ' ARG . . . . . . . . . . . . . 26.0 mtp-105 -52.9 148.96 6.88 Favored 'General case' 0 N--CA 1.476 0.836 0 N-CA-C 115.09 1.515 . . . . 0.0 115.09 -179.668 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B 1739 ' ' ARG . . . . . . . . . . . . . 18.4 ttp85 -93.01 151.23 20.02 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 125.654 1.582 . . . . 0.0 109.004 155.604 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B 1740 ' ' GLY . . . . . . . . . . . . . . . 83.89 173.83 49.99 Favored Glycine 0 CA--C 1.536 1.361 0 N-CA-C 110.645 -0.982 . . . . 0.0 110.645 -152.012 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B 1741 ' ' ARG . . . . . . . . . . . . . 47.5 ptt85 -69.92 134.62 48.61 Favored 'General case' 0 N--CA 1.48 1.052 0 CA-C-N 118.789 1.295 . . . . 0.0 113.435 -170.788 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B 1742 ' ' ASN . . . . . . . . . . . . . 15.5 m120 -88.32 62.73 6.81 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 126.123 1.769 . . . . 0.0 109.829 -176.174 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B 1743 ' ' LEU . . . . . . . . . . . . . 1.8 pt? -66.94 133.96 51.04 Favored 'General case' 0 CA--C 1.537 0.479 0 N-CA-C 114.016 1.117 . . . . 0.0 114.016 -166.916 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B 1744 ' ' THR . . . . . . . . . . . . . 7.8 t . . . . . 0 C--O 1.257 1.46 0 C-N-CA 126.857 2.063 . . . . 0.0 111.692 174.904 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 513' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 1.017 0 N-CA-C 110.519 -1.033 . . . . 0.0 110.519 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 514' ' ' ARG . . . . . . . . . . . . . 16.2 ptt85 -79.66 145.52 32.97 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 113.116 0.784 . . . . 0.0 113.116 -174.802 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 51.2 tp -78.61 -34.97 46.27 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.442 1.497 . . . . 0.0 113.765 -178.346 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 516' ' ' ASP . . . . . . . . . . . . . 31.8 t0 -64.61 148.36 51.04 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 123.809 0.843 . . . . 0.0 111.973 -172.288 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 517' ' ' LEU . . . . . 0.517 HD22 HD22 ' A' ' 548' ' ' LEU . 14.1 mt -131.65 159.83 70.15 Favored Pre-proline 0 CA--C 1.545 0.77 0 C-N-CA 126.691 1.996 . . . . 0.0 111.818 -169.406 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -68.45 159.26 54.18 Favored 'Trans proline' 0 CA--C 1.539 0.771 0 C-N-CA 123.957 3.105 . . . . 0.0 113.38 -172.734 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -61.89 128.42 24.24 Favored 'Trans proline' 0 N--CA 1.459 -0.536 0 C-N-CA 123.218 2.612 . . . . 0.0 111.321 -174.759 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 73.48 5.47 67.85 Favored Glycine 0 CA--C 1.537 1.446 0 CA-C-O 116.865 -2.075 . . . . 0.0 115.805 -177.177 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 22.2 t80 -35.67 133.96 0.37 Allowed 'General case' 0 N--CA 1.471 0.608 0 CA-C-N 120.508 2.154 . . . . 0.0 116.52 177.254 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 53.3 mtm -107.08 -57.45 2.07 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 123.541 0.736 . . . . 0.0 111.701 -177.301 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 523' ' ' PHE . . . . . . . . . . . . . 25.8 p90 -160.25 169.66 22.75 Favored 'General case' 0 C--O 1.222 -0.366 0 C-N-CA 125.168 1.387 . . . . 0.0 114.142 -174.571 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 524' ' ' LYS . . . . . 0.547 ' HG2' HD23 ' A' ' 548' ' ' LEU . 85.3 mttt -102.6 164.19 11.79 Favored 'General case' 0 CA--C 1.538 0.485 0 O-C-N 121.118 -0.989 . . . . 0.0 112.272 168.056 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 10.2 m -136.32 159.49 38.34 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 C-N-CA 127.051 2.14 . . . . 0.0 109.546 165.109 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 45.0 tt0 -123.58 128.57 49.89 Favored 'General case' 0 N--CA 1.475 0.779 0 CA-C-N 119.323 0.965 . . . . 0.0 112.213 168.755 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 527' ' ' ALA . . . . . 0.493 ' HA ' HG22 ' A' ' 589' ' ' THR . . . -64.03 122.61 16.95 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.103 0.961 . . . . 0.0 112.313 -179.275 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 48.5 mm-40 -88.23 -23.18 23.61 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.497 1.519 . . . . 0.0 111.867 174.514 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 93.8 m-70 -139.65 157.74 45.27 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 126.984 2.114 . . . . 0.0 110.206 -175.945 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 34.8 p-10 -87.19 135.65 33.22 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 119.374 0.988 . . . . 0.0 113.22 -179.503 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 83.0 t80 -128.63 110.03 11.87 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 124.6 1.16 . . . . 0.0 111.829 -178.332 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 532' ' ' THR . . . . . . . . . . . . 0.253 0.2 OUTLIER -82.91 113.91 20.84 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 114.148 1.166 . . . . 0.0 114.148 168.677 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -62.02 143.73 56.16 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 123.858 0.863 . . . . 0.0 112.186 175.43 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 534' ' ' THR . . . . . . . . . . . . 0.27 4.6 t -126.23 21.96 7.27 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 127.233 2.213 . . . . 0.0 114.36 179.496 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 38.7 t0 -152.63 156.24 38.88 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 107.565 -1.272 . . . . 0.0 107.565 165.764 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 5.0 t -68.17 -10.39 53.92 Favored 'General case' 0 N--CA 1.476 0.86 0 N-CA-C 114.956 1.465 . . . . 0.0 114.956 167.33 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 39.7 t0 -77.55 -31.03 53.02 Favored 'General case' 0 CA--C 1.553 1.07 0 C-N-CA 125.506 1.523 . . . . 0.0 110.989 167.037 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 82.8 mt-10 -81.52 147.16 29.81 Favored 'General case' 0 CA--C 1.547 0.835 0 O-C-N 120.265 -1.522 . . . . 0.0 113.67 -175.779 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -93.14 139.04 31.01 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 127.068 2.147 . . . . 0.0 110.31 176.027 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 15.6 tt0 -94.72 129.91 41.44 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.408 1.083 . . . . 0.0 111.574 179.423 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 76.7 mt -128.56 148.7 50.78 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.699 1.2 . . . . 0.0 112.86 -176.023 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 12.5 tmtt? -120.41 148.13 44.17 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 126.32 1.848 . . . . 0.0 109.841 169.766 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -56.29 99.5 0.03 OUTLIER 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 123.735 0.814 . . . . 0.0 111.856 174.981 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 127.73 -4.59 7.03 Favored Glycine 0 CA--C 1.537 1.456 0 C-N-CA 126.659 2.076 . . . . 0.0 114.304 -176.282 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 81.6 m-20 -79.33 120.88 24.4 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 119.395 1.597 . . . . 0.0 113.648 -176.018 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 36.6 t -74.49 135.01 28.33 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 CA-C-N 119.138 0.881 . . . . 0.0 110.15 168.695 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -123.1 122.21 64.96 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.508 0 C-N-CA 125.651 1.58 . . . . 0.0 111.496 174.549 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 548' ' ' LEU . . . . . 0.547 HD23 ' HG2' ' A' ' 524' ' ' LYS . 42.4 mt -78.44 101.2 7.18 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.457 1.103 . . . . 0.0 108.318 175.279 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 549' ' ' VAL . . . . . . . . . . . . . 4.4 t -63.97 131.49 29.62 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.337 0 N-CA-C 114.844 1.424 . . . . 0.0 114.844 173.313 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 15.8 pt -131.93 154.76 81.84 Favored Pre-proline 0 CA--C 1.548 0.903 0 C-N-CA 126.383 1.873 . . . . 0.0 111.28 -178.78 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -72.81 149.18 47.56 Favored 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 124.321 3.347 . . . . 0.0 111.785 173.597 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 63.6 m-85 -71.15 142.09 50.72 Favored 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 114.897 1.443 . . . . 0.0 114.897 -178.656 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 553' ' ' GLN . . . . . 0.506 ' CD ' ' H ' ' A' ' 553' ' ' GLN . 0.0 OUTLIER -71.05 -19.09 62.53 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 127.797 2.439 . . . . 0.0 114.302 169.072 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 17.7 m-20 -142.78 157.95 60.55 Favored Pre-proline 0 CA--C 1.542 0.667 0 C-N-CA 125.869 1.668 . . . . 0.0 112.658 -172.454 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 555' ' ' PRO . . . . . . . . . . . . . 95.0 Cg_endo -73.0 -43.4 0.76 Allowed 'Trans proline' 0 CA--C 1.54 0.822 0 C-N-CA 122.934 2.423 . . . . 0.0 110.998 159.834 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -71.65 -12.73 61.48 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 114.925 1.454 . . . . 0.0 114.925 -170.915 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 557' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -90.82 -19.4 23.47 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.263 1.425 . . . . 0.0 113.041 176.265 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 39.9 tt0 -87.1 114.32 23.61 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.8 1.24 . . . . 0.0 114.152 -176.435 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 54.5 m-20 -93.36 150.25 20.61 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 126.183 1.793 . . . . 0.0 111.726 174.677 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 30.7 tp10 -80.8 127.99 33.15 Favored 'General case' 0 N--CA 1.474 0.726 0 O-C-N 120.968 -1.083 . . . . 0.0 110.895 -177.334 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 83.88 4.9 88.4 Favored Glycine 0 CA--C 1.538 1.501 0 O-C-N 121.327 -0.858 . . . . 0.0 114.705 -173.153 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 562' ' ' TRP . . . . . 0.483 ' CZ2' ' HD3' ' B' 1736 ' ' ARG . 50.2 m95 -110.74 157.38 19.83 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 127.019 2.128 . . . . 0.0 112.598 178.401 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 11.5 mt -133.15 153.74 51.25 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 123.286 0.634 . . . . 0.0 110.992 173.564 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 41.9 ttm -106.37 142.76 35.51 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 123.997 0.919 . . . . 0.0 112.136 177.123 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -165.25 -170.34 30.07 Favored Glycine 0 CA--C 1.525 0.697 0 C-N-CA 124.282 0.944 . . . . 0.0 112.309 173.69 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 14.3 p -134.41 140.7 45.34 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.502 0 C-N-CA 125.966 1.707 . . . . 0.0 108.993 170.884 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 41.7 mtmt -62.42 134.76 56.89 Favored 'General case' 0 N--CA 1.465 0.304 0 O-C-N 121.139 -0.976 . . . . 0.0 112.064 176.636 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -57.36 -43.06 83.2 Favored 'General case' 0 C--O 1.222 -0.375 0 CA-C-O 118.12 -0.943 . . . . 0.0 111.391 -177.006 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 33.2 t -62.62 -33.1 74.32 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 119.358 0.981 . . . . 0.0 113.529 -178.849 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -69.69 -45.95 67.12 Favored 'General case' 0 CA--C 1.542 0.672 0 O-C-N 120.835 -1.166 . . . . 0.0 108.812 176.19 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 66.1 t-105 -66.72 -36.3 82.16 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 124.329 1.052 . . . . 0.0 112.525 179.49 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -67.78 -31.27 71.04 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 126.288 1.835 . . . . 0.0 111.783 175.213 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 44.1 mt-30 -77.09 -0.63 25.48 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.609 1.164 . . . . 0.0 113.73 172.287 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 67.0 m-70 68.37 18.85 9.05 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 127.99 2.516 . . . . 0.0 115.119 -178.406 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 6.7 mtpm? -76.34 160.71 29.35 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 125.233 1.413 . . . . 0.0 112.987 -173.982 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 18.1 pm0 -58.72 127.29 31.43 Favored 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 114.189 1.181 . . . . 0.0 114.189 -175.059 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 62.0 tp -75.31 -45.81 37.3 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 125.405 1.482 . . . . 0.0 111.891 -173.622 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 23.9 pt-20 -62.81 -18.33 62.61 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 113.856 1.058 . . . . 0.0 113.856 -174.506 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 4.2 tppp? -95.07 -41.57 9.05 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 126.065 1.746 . . . . 0.0 113.715 176.982 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 48.3 t -78.25 -28.18 47.7 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 118.568 0.622 . . . . 0.0 112.479 -179.796 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 50.7 ptt85 -54.08 149.47 9.35 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-O 121.74 0.781 . . . . 0.0 112.382 -179.74 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -172.47 170.73 43.77 Favored Glycine 0 N--CA 1.462 0.427 0 CA-C-N 115.358 -0.837 . . . . 0.0 114.348 177.025 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 17.6 m -91.91 136.78 23.59 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.252 0 C-N-CA 124.782 1.233 . . . . 0.0 111.43 171.854 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 44.6 p90 -132.57 154.79 81.65 Favored Pre-proline 0 CA--C 1.539 0.536 0 C-N-CA 124.358 1.063 . . . . 0.0 112.968 175.711 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -68.46 110.78 2.36 Favored 'Trans proline' 0 N--CA 1.457 -0.655 0 C-N-CA 122.262 1.975 . . . . 0.0 110.02 169.702 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 21.3 pt-20 -55.79 -29.49 59.77 Favored 'General case' 0 CA--C 1.547 0.855 0 O-C-N 121.416 -0.802 . . . . 0.0 112.233 -179.832 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 9.7 p-10 -67.22 -8.7 33.55 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 126.141 1.776 . . . . 0.0 114.523 179.446 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 17.1 m-85 -82.68 -11.9 58.0 Favored 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 116.783 2.142 . . . . 0.0 116.783 166.622 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 589' ' ' THR . . . . . 0.493 HG22 ' HA ' ' A' ' 527' ' ' ALA . 60.4 p -122.77 173.23 7.88 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 125.511 1.525 . . . . 0.0 111.528 -171.881 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -124.14 139.45 53.91 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.061 0.945 . . . . 0.0 108.997 170.13 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.82 136.23 57.25 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 125.149 1.379 . . . . 0.0 109.127 177.225 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 592' ' ' VAL . . . . . 0.524 HG23 ' HB2' ' A' ' 524' ' ' LYS . 2.4 m -126.87 155.57 75.27 Favored Pre-proline 0 N--CA 1.481 1.115 0 C-N-CA 124.78 1.232 . . . . 0.0 109.486 177.783 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 593' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo . . . . . 0 C--O 1.253 1.242 0 C-N-CA 124.325 3.35 . . . . 0.0 114.527 -170.825 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B 1728 ' ' SER . . . . . . . . . . . . . 89.4 p . . . . . 0 N--CA 1.472 0.658 0 CA-C-O 121.253 0.549 . . . . 0.0 110.803 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B 1729 ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -82.38 7.98 12.65 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 127.546 2.339 . . . . 0.0 117.118 -168.837 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B 1730 ' ' VAL . . . . . . . . . . . . . 16.6 m -62.67 151.56 83.87 Favored Pre-proline 0 CA--C 1.547 0.848 0 C-N-CA 126.075 1.75 . . . . 0.0 113.302 179.329 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -69.17 169.68 17.6 Favored 'Trans proline' 0 CA--C 1.542 0.879 0 C-N-CA 123.758 2.972 . . . . 0.0 112.966 175.757 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 2.9 t -132.49 138.86 51.24 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 C-N-CA 125.777 1.631 . . . . 0.0 112.96 178.869 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B 1733 ' ' ALA . . . . . 0.411 ' HB1' ' CZ2' ' A' ' 562' ' ' TRP . . . -72.63 139.7 80.99 Favored Pre-proline 0 CA--C 1.555 1.135 0 O-C-N 120.763 -1.211 . . . . 0.0 112.759 -176.558 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo -76.23 165.45 29.45 Favored 'Trans proline' 0 CA--C 1.553 1.428 0 C-N-CA 123.049 2.5 . . . . 0.0 114.181 -177.442 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 34.5 Cg_exo -64.66 154.3 73.03 Favored 'Trans proline' 0 C--N 1.351 0.703 0 C-N-CA 123.999 3.133 . . . . 0.0 114.207 179.723 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B 1736 ' ' ARG . . . . . 0.483 ' HD3' ' CZ2' ' A' ' 562' ' ' TRP . 16.1 mtm180 -124.07 167.82 13.7 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 124.98 1.312 . . . . 0.0 112.616 -173.206 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B 1737 ' ' ARG . . . . . . . . . . . . . 65.8 mtt-85 -106.93 156.82 18.3 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 125.904 1.681 . . . . 0.0 114.723 -170.986 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B 1738 ' ' ARG . . . . . . . . . . . . . 13.0 tpt180 -67.77 116.15 8.12 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 124.632 1.173 . . . . 0.0 111.136 175.679 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B 1739 ' ' ARG . . . . . . . . . . . . . 14.5 ttp85 -80.77 144.68 31.95 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 124.166 0.986 . . . . 0.0 111.066 171.044 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B 1740 ' ' GLY . . . . . . . . . . . . . . . 64.77 -156.14 47.18 Favored Glycine 0 CA--C 1.53 1.029 0 C-N-CA 123.422 0.534 . . . . 0.0 113.43 -168.098 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B 1741 ' ' ARG . . . . . . . . . . . . . 17.6 tpp180 -111.2 138.54 47.52 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.334 1.054 . . . . 0.0 111.16 -178.77 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B 1742 ' ' ASN . . . . . . . . . . . . . 46.3 p-10 -57.88 19.83 0.0 OUTLIER 'General case' 0 CA--C 1.554 1.116 0 C-N-CA 129.091 2.956 . . . . 0.0 117.493 172.11 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B 1743 ' ' LEU . . . . . . . . . . . . . 65.0 tp -55.28 -55.59 29.67 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 125.404 1.482 . . . . 0.0 112.815 -171.476 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B 1744 ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.255 1.395 0 N-CA-C 116.754 2.131 . . . . 0.0 116.754 177.103 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 513' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.215 0 N-CA-C 112.422 -0.271 . . . . 0.0 112.422 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 514' ' ' ARG . . . . . . . . . . . . . 6.7 ppt_? -65.25 169.92 5.2 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 127.477 2.311 . . . . 0.0 115.809 -175.16 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 83.6 mt -84.83 -74.24 0.4 Allowed 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 125.119 1.368 . . . . 0.0 110.668 168.249 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 516' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -117.44 154.69 30.95 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 116.846 2.165 . . . . 0.0 116.846 -175.034 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 517' ' ' LEU . . . . . 0.52 HD22 HD22 ' A' ' 548' ' ' LEU . 14.9 mt -65.36 163.56 31.5 Favored Pre-proline 0 CA--C 1.551 0.992 0 C-N-CA 125.852 1.661 . . . . 0.0 112.605 166.348 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_endo -67.8 162.14 40.86 Favored 'Trans proline' 0 CA--C 1.539 0.775 0 C-N-CA 123.755 2.97 . . . . 0.0 114.055 -176.056 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -64.11 138.67 63.0 Favored 'Trans proline' 0 C--N 1.348 0.546 0 C-N-CA 122.78 2.32 . . . . 0.0 109.89 176.348 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 70.58 4.72 53.69 Favored Glycine 0 CA--C 1.532 1.114 0 CA-C-O 117.638 -1.646 . . . . 0.0 115.69 -176.016 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 48.8 t80 -44.72 129.87 7.03 Favored 'General case' 0 C--O 1.238 0.494 0 CA-C-N 120.82 2.31 . . . . 0.0 115.216 179.697 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 60.1 mtm -105.36 -59.09 1.81 Allowed 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 123.883 0.873 . . . . 0.0 111.932 -179.151 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 523' ' ' PHE . . . . . 0.573 ' CD1' ' HD3' ' A' ' 591' ' ' ARG . 32.5 p90 -160.34 175.45 12.82 Favored 'General case' 0 C--O 1.224 -0.252 0 C-N-CA 126.155 1.782 . . . . 0.0 112.406 -175.555 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 524' ' ' LYS . . . . . 0.517 ' HG2' HD23 ' A' ' 548' ' ' LEU . 81.3 mttt -106.51 164.09 12.34 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 121.023 -1.048 . . . . 0.0 112.65 171.332 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 12.0 m -131.62 160.94 42.02 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 C-N-CA 126.145 1.778 . . . . 0.0 109.552 164.377 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 45.2 tt0 -122.19 128.03 50.72 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 118.613 0.642 . . . . 0.0 111.423 166.986 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 527' ' ' ALA . . . . . 0.402 ' HA ' HG22 ' A' ' 589' ' ' THR . . . -56.63 123.35 14.55 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.241 1.016 . . . . 0.0 111.209 173.049 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 42.3 mm-40 -84.84 -27.45 26.74 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.153 1.381 . . . . 0.0 110.91 168.596 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 46.9 m80 -139.34 160.18 40.43 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 127.065 2.146 . . . . 0.0 111.657 -174.23 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . 0.314 1.6 p30 -84.19 138.2 33.11 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 115.713 1.746 . . . . 0.0 115.713 178.932 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 89.3 t80 -138.25 128.33 25.69 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.609 1.564 . . . . 0.0 114.298 -176.147 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -90.8 128.2 36.62 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 124.7 1.2 . . . . 0.0 114.189 175.03 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -69.99 121.78 18.07 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 119.161 0.891 . . . . 0.0 110.822 173.032 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 12.2 t -88.51 -20.55 24.97 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 115.049 1.5 . . . . 0.0 115.049 -177.766 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 18.8 m-20 -145.18 177.5 8.75 Favored 'General case' 0 CA--C 1.554 1.11 0 N-CA-C 116.872 2.175 . . . . 0.0 116.872 -165.856 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 5.3 t -59.37 -17.81 33.28 Favored 'General case' 0 N--CA 1.481 1.09 0 N-CA-C 119.141 3.015 . . . . 0.0 119.141 -173.67 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . 0.287 18.8 m-20 -129.14 16.73 6.14 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 125.9 1.68 . . . . 0.0 115.18 175.776 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 20.0 mp0 -95.67 145.0 25.61 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.947 1.299 . . . . 0.0 112.797 -174.985 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -99.61 128.72 45.72 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 125.194 1.398 . . . . 0.0 111.538 -172.979 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 38.0 tt0 -84.64 124.95 32.04 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 124.843 1.257 . . . . 0.0 110.396 176.982 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 79.9 mt -125.12 145.99 49.68 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 124.925 1.29 . . . . 0.0 112.275 -178.933 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -115.11 143.73 44.75 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 125.817 1.647 . . . . 0.0 109.367 168.829 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -55.72 110.12 0.67 Allowed 'General case' 0 CA--C 1.545 0.777 0 CA-C-N 118.503 0.592 . . . . 0.0 110.705 179.736 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 115.78 -5.58 20.54 Favored Glycine 0 CA--C 1.538 1.488 0 C-N-CA 126.415 1.96 . . . . 0.0 114.618 -174.796 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 83.2 m-20 -72.82 124.64 25.79 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 115.794 1.775 . . . . 0.0 115.794 -176.906 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 41.7 t -72.84 133.71 31.22 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 C-N-CA 123.68 0.792 . . . . 0.0 110.156 169.116 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 1.5 t -128.07 123.66 60.99 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.328 0 C-N-CA 124.57 1.148 . . . . 0.0 111.527 174.301 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 548' ' ' LEU . . . . . 0.52 HD22 HD22 ' A' ' 517' ' ' LEU . 30.1 mt -79.98 100.47 8.14 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.004 1.322 . . . . 0.0 108.55 177.465 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 549' ' ' VAL . . . . . 0.41 HG21 ' CE1' ' A' ' 523' ' ' PHE . 7.1 t -61.1 132.14 26.46 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.267 0 N-CA-C 114.924 1.453 . . . . 0.0 114.924 173.928 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 20.9 pt -129.99 157.45 76.9 Favored Pre-proline 0 CA--C 1.551 0.981 0 C-N-CA 127.098 2.159 . . . . 0.0 109.873 174.924 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -73.66 154.69 49.56 Favored 'Trans proline' 0 CA--C 1.536 0.601 0 C-N-CA 124.021 3.147 . . . . 0.0 112.094 174.911 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 36.8 m-85 -66.72 149.01 51.14 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 117.195 2.294 . . . . 0.0 117.195 176.395 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 553' ' ' GLN . . . . . . . . . . . . . 6.3 pt20 -70.2 -22.12 62.96 Favored 'General case' 0 N--CA 1.475 0.775 0 N-CA-C 114.243 1.201 . . . . 0.0 114.243 174.562 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 -147.6 146.26 24.0 Favored Pre-proline 0 CA--C 1.54 0.585 0 C-N-CA 125.865 1.666 . . . . 0.0 109.741 170.343 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 555' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -65.57 -35.4 38.3 Favored 'Trans proline' 0 CA--C 1.536 0.604 0 C-N-CA 123.027 2.484 . . . . 0.0 110.831 172.762 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 24.4 pt-20 -72.88 -7.7 52.13 Favored 'General case' 0 CA--C 1.547 0.848 0 N-CA-C 114.492 1.293 . . . . 0.0 114.492 177.237 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 557' ' ' GLU . . . . . . . . . . . . . 21.9 mm-40 -86.58 -23.37 25.8 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 124.787 1.235 . . . . 0.0 113.138 165.892 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -73.76 123.9 25.03 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 123.91 0.884 . . . . 0.0 113.375 -172.252 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . 0.292 18.5 m-20 -96.6 140.03 31.81 Favored 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 116.554 2.057 . . . . 0.0 116.554 -179.175 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 54.9 tp10 -73.88 120.81 19.98 Favored 'General case' 0 CA--C 1.539 0.537 0 O-C-N 120.955 -1.091 . . . . 0.0 112.078 -173.563 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 87.82 3.12 80.63 Favored Glycine 0 CA--C 1.536 1.36 0 C-N-CA 124.514 1.054 . . . . 0.0 114.599 -172.68 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 57.1 m95 -100.98 164.52 11.78 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.569 1.548 . . . . 0.0 112.919 176.284 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 11.6 mt -137.77 152.4 49.13 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 124.943 1.297 . . . . 0.0 109.831 168.699 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 52.1 ttm -108.1 141.97 39.0 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 124.306 1.042 . . . . 0.0 111.503 172.516 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -169.85 -171.79 35.74 Favored Glycine 0 CA--C 1.526 0.767 0 C-N-CA 124.543 1.068 . . . . 0.0 112.666 176.188 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 14.7 p -132.65 138.54 51.79 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 C-N-CA 125.66 1.584 . . . . 0.0 108.893 171.085 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 37.9 mtmt -59.09 139.42 56.89 Favored 'General case' 0 N--CA 1.467 0.42 0 O-C-N 121.224 -0.922 . . . . 0.0 111.167 176.052 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 14.1 tt0 -60.0 -43.19 95.37 Favored 'General case' 0 C--O 1.222 -0.379 0 CA-C-O 119.008 -0.52 . . . . 0.0 110.742 176.524 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 76.4 p -60.05 -34.62 73.66 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 114.403 1.26 . . . . 0.0 114.403 176.467 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 40.9 m-20 -71.15 -45.84 62.71 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.281 1.432 . . . . 0.0 113.893 173.719 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 56.6 t-105 -71.46 -34.79 70.54 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 125.065 1.346 . . . . 0.0 113.834 178.332 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 33.6 t-20 -67.61 -21.81 65.39 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 125.586 1.554 . . . . 0.0 111.881 176.747 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 23.6 mm-40 -89.02 6.51 39.36 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.816 1.246 . . . . 0.0 114.279 169.411 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 2.2 m-70 61.92 23.57 13.89 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 125.79 1.636 . . . . 0.0 113.938 171.66 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 19.2 mtpp -74.56 168.48 19.68 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 125.931 1.693 . . . . 0.0 113.016 -175.774 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 8.3 pm0 -56.72 97.66 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.974 1.71 . . . . 0.0 113.327 -176.632 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 60.6 tp -54.23 -43.26 70.7 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.328 1.451 . . . . 0.0 111.906 -173.807 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -63.01 -33.85 76.31 Favored 'General case' 0 N--CA 1.476 0.859 0 N-CA-C 113.131 0.789 . . . . 0.0 113.131 -176.743 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 29.6 mmtp -88.49 -39.05 14.49 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 123.673 0.789 . . . . 0.0 112.511 175.981 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 93.6 m -71.83 -35.09 69.79 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 113.274 0.842 . . . . 0.0 113.274 -177.176 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.13 169.98 1.83 Allowed 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.174 0.99 . . . . 0.0 112.07 176.918 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -178.78 177.56 48.49 Favored Glycine 0 N--CA 1.45 -0.399 0 CA-C-N 114.606 -1.179 . . . . 0.0 114.414 166.978 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 19.3 m -88.88 141.61 14.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 C-N-CA 124.66 1.184 . . . . 0.0 111.542 166.227 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 39.8 p90 -136.5 154.06 76.55 Favored Pre-proline 0 CA--C 1.538 0.518 0 C-N-CA 125.395 1.478 . . . . 0.0 112.187 175.149 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -65.9 112.45 2.24 Favored 'Trans proline' 0 N--CA 1.46 -0.479 0 C-N-CA 121.788 1.659 . . . . 0.0 108.898 170.134 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 18.7 pt-20 -56.28 -30.8 62.96 Favored 'General case' 0 N--CA 1.471 0.604 0 O-C-N 121.346 -0.846 . . . . 0.0 111.459 -178.015 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 8.4 p-10 -63.49 -18.16 63.51 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 126.081 1.752 . . . . 0.0 113.914 178.667 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 9.5 m-85 -74.39 -13.97 60.8 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 116.125 1.898 . . . . 0.0 116.125 166.98 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 589' ' ' THR . . . . . 0.402 HG22 ' HA ' ' A' ' 527' ' ' ALA . 30.9 p -121.76 176.67 5.62 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 127.043 2.137 . . . . 0.0 112.199 -176.682 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 15.8 pt-20 -131.69 138.51 48.73 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.757 1.223 . . . . 0.0 109.808 168.476 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 591' ' ' ARG . . . . . 0.573 ' HD3' ' CD1' ' A' ' 523' ' ' PHE . 4.0 tpt180 -66.1 120.82 13.85 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 125.304 1.442 . . . . 0.0 111.294 176.252 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 592' ' ' VAL . . . . . 0.443 HG23 ' HB2' ' A' ' 524' ' ' LYS . 3.8 m -108.0 154.46 41.12 Favored Pre-proline 0 N--CA 1.477 0.915 0 C-N-CA 125.241 1.416 . . . . 0.0 109.328 -178.154 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 593' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo . . . . . 0 C--O 1.251 1.172 0 C-N-CA 123.635 2.89 . . . . 0.0 113.526 -174.467 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B 1728 ' ' SER . . . . . . . . . . . . . 41.7 t . . . . . 0 N--CA 1.47 0.56 0 N-CA-C 109.484 -0.562 . . . . 0.0 109.484 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B 1729 ' ' THR . . . . . . . . . . . . . 30.6 p -73.23 -10.69 60.03 Favored 'General case' 0 N--CA 1.479 1.014 0 N-CA-C 115.904 1.816 . . . . 0.0 115.904 -171.275 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B 1730 ' ' VAL . . . . . . . . . . . . . 2.9 m -67.61 143.31 96.8 Favored Pre-proline 0 N--CA 1.476 0.856 0 N-CA-C 113.477 0.918 . . . . 0.0 113.477 -179.121 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -73.19 164.75 34.51 Favored 'Trans proline' 0 CA--C 1.54 0.804 0 C-N-CA 123.927 3.085 . . . . 0.0 112.713 174.369 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 31.6 t -129.78 132.38 65.94 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 C-N-CA 125.73 1.612 . . . . 0.0 110.697 176.745 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -67.4 144.97 98.31 Favored Pre-proline 0 CA--C 1.549 0.939 0 N-CA-C 113.077 0.769 . . . . 0.0 113.077 -172.69 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -77.99 168.66 21.72 Favored 'Trans proline' 0 CA--C 1.548 1.183 0 C-N-CA 122.949 2.433 . . . . 0.0 112.391 175.35 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 77.8 Cg_exo -58.46 157.99 24.79 Favored 'Trans proline' 0 CA--C 1.542 0.906 0 C-N-CA 123.719 2.946 . . . . 0.0 114.357 177.247 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B 1736 ' ' ARG . . . . . . . . . . . . . 11.8 mtp-105 -131.31 164.07 26.43 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 126.045 1.738 . . . . 0.0 112.924 174.351 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B 1737 ' ' ARG . . . . . . . . . . . . . 31.5 mtt85 -135.88 -32.75 0.87 Allowed 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 126.604 1.961 . . . . 0.0 111.714 -172.985 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B 1738 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 58.6 11.25 1.68 Allowed 'General case' 0 N--CA 1.494 1.757 0 C-N-CA 128.106 2.563 . . . . 0.0 116.798 163.231 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B 1739 ' ' ARG . . . . . . . . . . . . . 1.2 tpm_? 54.79 39.23 31.29 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 127.326 2.25 . . . . 0.0 113.348 -162.909 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B 1740 ' ' GLY . . . . . . . . . . . . . . . -115.07 -167.48 15.4 Favored Glycine 0 CA--C 1.536 1.344 0 C-N-CA 125.794 1.664 . . . . 0.0 112.469 171.828 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B 1741 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.18 86.22 1.9 Allowed 'General case' 0 N--CA 1.476 0.858 0 CA-C-O 122.192 0.996 . . . . 0.0 110.216 173.992 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B 1742 ' ' ASN . . . . . . . . . . . . . 9.9 p-10 -64.38 161.39 17.04 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.4 1.48 . . . . 0.0 113.346 178.402 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B 1743 ' ' LEU . . . . . . . . . . . . . 1.7 pt? -71.3 148.8 46.76 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 122.96 0.504 . . . . 0.0 111.322 158.43 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B 1744 ' ' THR . . . . . . . . . . . . 0.328 0.2 OUTLIER . . . . . 0 N--CA 1.482 1.132 0 N-CA-C 115.983 1.846 . . . . 0.0 115.983 179.796 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 513' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.119 0 N-CA-C 111.918 -0.473 . . . . 0.0 111.918 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 514' ' ' ARG . . . . . . . . . . . . . 2.2 mmp_? -78.65 160.3 27.59 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 125.979 1.712 . . . . 0.0 114.485 -174.08 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -105.23 -40.39 5.87 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 125.248 1.419 . . . . 0.0 111.355 168.254 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 516' ' ' ASP . . . . . . . . . . . . . 39.2 t0 -73.76 133.83 43.35 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 122.682 1.229 . . . . 0.0 108.79 167.398 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 517' ' ' LEU . . . . . 0.45 HD22 HD22 ' A' ' 548' ' ' LEU . 9.3 mt -136.49 159.61 69.91 Favored Pre-proline 0 CA--C 1.541 0.632 0 C-N-CA 125.644 1.578 . . . . 0.0 111.197 -167.231 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 29.9 Cg_endo -67.89 157.44 61.79 Favored 'Trans proline' 0 CA--C 1.541 0.834 0 C-N-CA 123.362 2.708 . . . . 0.0 113.791 -171.209 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_endo -62.46 127.51 21.06 Favored 'Trans proline' 0 N--CA 1.459 -0.551 0 C-N-CA 123.584 2.856 . . . . 0.0 110.074 179.406 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 76.46 1.92 72.5 Favored Glycine 0 CA--C 1.532 1.155 0 CA-C-O 117.616 -1.658 . . . . 0.0 115.785 -175.711 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 30.1 t80 -36.78 128.28 0.85 Allowed 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 116.912 2.19 . . . . 0.0 116.912 178.013 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 52.3 mtm -100.11 -55.1 2.71 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 123.081 0.552 . . . . 0.0 112.178 -178.489 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 523' ' ' PHE . . . . . . . . . . . . . 24.6 p90 -165.62 170.38 14.27 Favored 'General case' 0 C--O 1.222 -0.345 0 C-N-CA 126.323 1.849 . . . . 0.0 112.654 -172.936 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 524' ' ' LYS . . . . . 0.52 ' HE2' ' CD2' ' A' ' 548' ' ' LEU . 78.5 mttt -102.18 162.9 12.56 Favored 'General case' 0 CA--C 1.538 0.483 0 O-C-N 121.169 -0.957 . . . . 0.0 111.807 169.298 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 17.7 m -136.24 160.98 38.08 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.904 0 C-N-CA 127.21 2.204 . . . . 0.0 108.788 166.19 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 41.3 tt0 -126.23 125.99 43.3 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 119.204 0.911 . . . . 0.0 111.587 175.347 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 527' ' ' ALA . . . . . 0.505 ' HA ' HG22 ' A' ' 589' ' ' THR . . . -58.24 132.84 54.78 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 124.011 0.924 . . . . 0.0 111.391 -179.783 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 84.0 mm-40 -102.46 -23.8 13.89 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 125.941 1.696 . . . . 0.0 112.179 173.201 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 89.9 m-70 -138.13 160.07 40.38 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 126.254 1.822 . . . . 0.0 111.01 -179.05 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -83.1 128.22 34.29 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 125.28 1.432 . . . . 0.0 113.966 -178.912 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 84.9 t80 -130.69 122.65 27.71 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 115.107 1.521 . . . . 0.0 115.107 -176.973 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -95.68 134.77 38.2 Favored 'General case' 0 N--CA 1.48 1.069 0 N-CA-C 115.652 1.723 . . . . 0.0 115.652 174.114 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -74.59 120.51 20.24 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-O 122.12 0.962 . . . . 0.0 112.947 -175.817 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 4.4 t -90.79 6.98 42.05 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 126.836 2.054 . . . . 0.0 115.84 179.894 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -153.23 155.13 36.04 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 129.172 2.989 . . . . 0.0 111.685 -178.61 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 536' ' ' THR . . . . . . . . . . . . 0.264 0.9 OUTLIER -65.38 -25.56 67.62 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 116.124 1.898 . . . . 0.0 116.124 177.16 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 90.2 m-20 -92.74 -8.58 43.39 Favored 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 115.47 1.656 . . . . 0.0 115.47 175.594 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -74.47 146.46 42.77 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.767 1.227 . . . . 0.0 110.909 174.447 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -84.9 159.4 20.34 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 126.398 1.879 . . . . 0.0 110.202 174.637 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 17.8 tt0 -118.84 138.6 52.61 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.454 1.502 . . . . 0.0 110.658 173.844 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 91.3 mt -133.2 141.23 47.98 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 125.082 1.353 . . . . 0.0 111.953 -174.79 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.23 143.28 40.61 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 125.063 1.345 . . . . 0.0 108.507 164.812 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -53.83 117.8 3.46 Favored 'General case' 0 CA--C 1.548 0.894 0 O-C-N 121.633 -0.667 . . . . 0.0 111.94 -179.868 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 110.85 -9.71 29.77 Favored Glycine 0 CA--C 1.532 1.109 0 C-N-CA 126.772 2.13 . . . . 0.0 113.939 -175.347 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 69.0 m-20 -74.83 121.44 21.82 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 118.689 1.245 . . . . 0.0 113.377 -173.881 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 2.7 t -72.31 136.1 26.37 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 O-C-N 121.713 -0.617 . . . . 0.0 112.071 172.393 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -124.08 122.27 63.99 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.6 0 C-N-CA 126.16 1.784 . . . . 0.0 111.428 175.93 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 548' ' ' LEU . . . . . 0.52 ' CD2' ' HE2' ' A' ' 524' ' ' LYS . 20.0 mt -78.37 99.42 6.36 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.637 1.175 . . . . 0.0 108.637 174.983 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 549' ' ' VAL . . . . . . . . . . . . . 6.1 t -60.92 133.12 26.7 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.268 0 N-CA-C 114.583 1.327 . . . . 0.0 114.583 172.984 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 16.8 pt -130.42 156.17 79.95 Favored Pre-proline 0 CA--C 1.55 0.958 0 C-N-CA 126.77 2.028 . . . . 0.0 110.428 177.965 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 92.3 Cg_endo -72.19 165.55 32.3 Favored 'Trans proline' 0 CA--C 1.536 0.596 0 C-N-CA 124.194 3.263 . . . . 0.0 111.638 173.024 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 66.0 m-85 -85.14 158.79 20.3 Favored 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 116.28 1.956 . . . . 0.0 116.28 -177.692 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 553' ' ' GLN . . . . . 0.498 ' CD ' ' H ' ' A' ' 553' ' ' GLN . 0.1 OUTLIER -76.93 -20.3 56.34 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 124.789 1.235 . . . . 0.0 114.03 167.399 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 13.0 m-20 -154.31 149.78 21.05 Favored Pre-proline 0 CA--C 1.539 0.538 0 C-N-CA 124.623 1.169 . . . . 0.0 112.034 173.576 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 555' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -64.92 -29.4 57.99 Favored 'Trans proline' 0 CA--C 1.539 0.773 0 C-N-CA 123.482 2.788 . . . . 0.0 112.569 174.54 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 17.1 pt-20 -82.92 -6.01 59.28 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 125.87 1.668 . . . . 0.0 114.476 171.934 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 557' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -88.2 -10.21 50.54 Favored 'General case' 0 N--CA 1.478 0.949 0 N-CA-C 114.578 1.325 . . . . 0.0 114.578 167.49 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 4.5 tp60 -82.03 148.97 28.34 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 124.237 1.015 . . . . 0.0 112.072 164.181 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -113.33 141.9 46.49 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 128.146 2.578 . . . . 0.0 113.607 171.169 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 82.5 tt0 -64.42 120.34 12.08 Favored 'General case' 0 N--CA 1.478 0.948 0 O-C-N 119.654 -1.904 . . . . 0.0 112.032 -171.168 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 85.13 5.71 85.42 Favored Glycine 0 CA--C 1.539 1.576 0 C-N-CA 124.897 1.237 . . . . 0.0 115.826 -175.42 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 562' ' ' TRP . . . . . 0.422 ' CZ2' ' HD3' ' B' 1736 ' ' ARG . 41.1 m95 -94.33 173.21 7.75 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 125.386 1.474 . . . . 0.0 113.86 178.396 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 17.3 mt -139.92 154.34 47.21 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 125.137 1.375 . . . . 0.0 110.618 166.704 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 31.4 tpp -107.34 143.33 35.78 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 125.28 1.432 . . . . 0.0 110.932 168.731 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -169.41 -172.42 36.04 Favored Glycine 0 CA--C 1.526 0.742 0 C-N-CA 124.38 0.991 . . . . 0.0 112.607 174.376 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 12.0 p -134.22 140.41 46.13 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.568 0 C-N-CA 125.569 1.548 . . . . 0.0 109.124 173.586 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 35.9 mtmt -56.39 136.16 53.79 Favored 'General case' 0 N--CA 1.468 0.428 0 O-C-N 121.24 -0.913 . . . . 0.0 111.356 176.347 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 52.3 tt0 -61.57 -42.41 98.8 Favored 'General case' 0 C--O 1.22 -0.449 0 CA-C-O 117.868 -1.063 . . . . 0.0 110.71 176.355 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 40.1 t -58.58 -37.2 75.26 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 119.696 1.135 . . . . 0.0 112.501 174.634 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 73.6 m-20 -63.75 -44.27 94.0 Favored 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 114.771 1.397 . . . . 0.0 114.771 172.516 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 55.3 t-105 -75.35 -29.36 59.91 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 124.941 1.296 . . . . 0.0 113.634 177.953 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 5.6 t-20 -68.44 -33.51 74.34 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 126.638 1.975 . . . . 0.0 110.711 172.873 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 30.5 mm100 -79.06 -3.7 46.54 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 124.636 1.174 . . . . 0.0 113.92 167.945 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 574' ' ' HIS . . . . . . . . . . . . 0.283 86.4 m-70 64.13 31.93 13.0 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 127.605 2.362 . . . . 0.0 115.547 168.65 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 78.2 mttt -66.6 170.87 5.69 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 127.566 2.346 . . . . 0.0 114.108 -178.225 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 21.4 pt-20 -59.95 104.65 0.32 Allowed 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 124.629 1.172 . . . . 0.0 113.031 171.738 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 57.7 tp -55.74 -42.84 75.98 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 124.226 1.01 . . . . 0.0 112.421 -171.204 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 2.8 pt-20 -61.86 -30.48 70.88 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 114.73 1.381 . . . . 0.0 114.73 -176.131 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 28.2 mmmt -97.47 -30.68 12.76 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 123.547 0.739 . . . . 0.0 112.819 -179.677 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 32.8 m -70.27 -40.39 74.36 Favored 'General case' 0 CA--C 1.538 0.492 0 N-CA-C 113.507 0.928 . . . . 0.0 113.507 173.141 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 29.6 ptt85 -64.39 161.81 16.26 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 123.867 0.867 . . . . 0.0 112.781 178.374 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -175.44 173.39 46.21 Favored Glycine 0 CA--C 1.52 0.354 0 CA-C-N 115.4 -0.818 . . . . 0.0 114.032 174.15 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 30.1 m -87.87 143.7 10.74 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.274 0 C-N-CA 123.262 0.625 . . . . 0.0 110.199 171.76 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 45.4 p90 -143.55 156.58 60.02 Favored Pre-proline 0 CA--C 1.541 0.629 0 C-N-CA 124.742 1.217 . . . . 0.0 112.346 176.7 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -69.75 111.21 2.75 Favored 'Trans proline' 0 C--N 1.347 0.49 0 C-N-CA 122.291 1.994 . . . . 0.0 109.903 172.762 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 19.6 pt-20 -55.82 -29.71 60.23 Favored 'General case' 0 N--CA 1.475 0.806 0 O-C-N 121.547 -0.721 . . . . 0.0 112.076 -179.07 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 10.9 p-10 -66.32 -20.97 66.24 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 125.604 1.561 . . . . 0.0 114.001 178.612 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 14.0 m-85 -69.07 -14.46 63.03 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 116.717 2.117 . . . . 0.0 116.717 164.605 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 589' ' ' THR . . . . . 0.505 HG22 ' HA ' ' A' ' 527' ' ' ALA . 63.5 p -122.0 173.43 7.54 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 126.277 1.831 . . . . 0.0 111.097 -176.357 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 15.1 pt-20 -126.55 136.34 52.44 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 124.245 1.018 . . . . 0.0 109.001 173.474 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.41 128.22 35.6 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 124.247 1.019 . . . . 0.0 108.692 178.606 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 592' ' ' VAL . . . . . 0.459 HG23 ' HB2' ' A' ' 524' ' ' LYS . 1.9 m -110.76 150.7 42.16 Favored Pre-proline 0 CA--C 1.548 0.886 0 C-N-CA 125.624 1.57 . . . . 0.0 107.666 178.019 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 593' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_exo . . . . . 0 C--O 1.254 1.282 1 C-N-CA 126.52 4.814 . . . . 0.0 116.431 -174.537 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B 1728 ' ' SER . . . . . . . . . . . . . 42.3 t . . . . . 0 N--CA 1.475 0.804 0 CA-C-O 118.052 -0.975 . . . . 0.0 111.859 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B 1729 ' ' THR . . . . . . . . . . . . 0.41 0.3 OUTLIER -125.99 -6.61 6.67 Favored 'General case' 0 N--CA 1.487 1.407 0 N-CA-C 118.139 2.644 . . . . 0.0 118.139 -177.248 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B 1730 ' ' VAL . . . . . . . . . . . . . 1.3 m -139.94 139.51 21.77 Favored Pre-proline 0 CA--C 1.546 0.822 0 C-N-CA 126.32 1.848 . . . . 0.0 114.436 173.884 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 68.5 Cg_endo -73.36 168.76 23.93 Favored 'Trans proline' 0 CA--C 1.543 0.974 0 C-N-CA 123.837 3.025 . . . . 0.0 113.633 -179.744 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 16.0 t -128.74 126.14 64.51 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.126 0 C-N-CA 125.194 1.398 . . . . 0.0 112.495 -177.081 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -65.79 129.12 94.25 Favored Pre-proline 0 CA--C 1.55 0.969 0 O-C-N 121.533 -0.729 . . . . 0.0 111.475 -178.542 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 26.6 Cg_endo -69.42 157.16 62.07 Favored 'Trans proline' 0 CA--C 1.544 0.985 0 C-N-CA 122.165 1.91 . . . . 0.0 112.718 -173.847 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -63.95 122.27 10.24 Favored 'Trans proline' 0 CA--C 1.538 0.682 0 C-N-CA 123.054 2.503 . . . . 0.0 111.944 -174.809 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B 1736 ' ' ARG . . . . . 0.422 ' HD3' ' CZ2' ' A' ' 562' ' ' TRP . 36.0 mtm180 -87.28 150.86 23.59 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 125.471 1.508 . . . . 0.0 110.724 179.952 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B 1737 ' ' ARG . . . . . . . . . . . . . 10.9 mmt85 -98.7 -72.53 0.65 Allowed 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 124.495 1.118 . . . . 0.0 112.801 -169.07 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B 1738 ' ' ARG . . . . . . . . . . . . . 15.5 ptt-85 -152.48 -25.75 0.17 Allowed 'General case' 0 N--CA 1.486 1.344 0 N-CA-C 116.062 1.875 . . . . 0.0 116.062 179.783 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B 1739 ' ' ARG . . . . . . . . . . . . . 2.9 ttp85 47.42 65.78 1.18 Allowed 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 127.316 2.246 . . . . 0.0 114.393 175.188 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B 1740 ' ' GLY . . . . . . . . . . . . . . . 75.15 15.45 81.11 Favored Glycine 0 CA--C 1.54 1.649 0 N-CA-C 116.691 1.436 . . . . 0.0 116.691 174.854 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B 1741 ' ' ARG . . . . . . . . . . . . . 8.8 tpm_? -131.56 94.78 3.6 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 125.334 1.453 . . . . 0.0 111.439 175.775 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B 1742 ' ' ASN . . . . . . . . . . . . . 10.3 p30 -68.61 158.78 33.31 Favored 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 123.56 0.744 . . . . 0.0 112.043 176.066 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B 1743 ' ' LEU . . . . . . . . . . . . . 55.8 tp -64.09 131.58 47.95 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.536 1.134 . . . . 0.0 113.989 -171.516 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B 1744 ' ' THR . . . . . . . . . . . . . 4.4 p . . . . . 0 C--O 1.252 1.211 0 C-N-CA 126.944 2.097 . . . . 0.0 115.823 -179.421 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 513' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.904 0 N-CA-C 110.838 -0.905 . . . . 0.0 110.838 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 514' ' ' ARG . . . . . . . . . . . . . 13.9 ptm180 -69.64 -31.14 69.06 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 114.802 1.408 . . . . 0.0 114.802 -169.999 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 54.6 mt 57.35 -26.62 0.02 OUTLIER 'General case' 0 CA--C 1.553 1.063 0 C-N-CA 128.345 2.658 . . . . 0.0 117.58 -172.589 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 516' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -73.18 161.98 29.94 Favored 'General case' 0 CA--C 1.545 0.773 0 CA-C-N 120.017 1.28 . . . . 0.0 111.336 179.172 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 517' ' ' LEU . . . . . 0.475 HD22 HD22 ' A' ' 548' ' ' LEU . 14.0 mt -128.69 160.39 63.15 Favored Pre-proline 0 CA--C 1.543 0.687 0 C-N-CA 125.015 1.326 . . . . 0.0 113.419 -162.413 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_endo -66.2 159.53 49.29 Favored 'Trans proline' 0 CA--C 1.538 0.708 0 C-N-CA 123.923 3.082 . . . . 0.0 114.241 -174.039 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 96.1 Cg_endo -68.36 130.15 20.56 Favored 'Trans proline' 0 N--CA 1.457 -0.622 0 C-N-CA 123.366 2.71 . . . . 0.0 109.628 -179.742 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 78.84 1.23 83.9 Favored Glycine 0 CA--C 1.537 1.454 0 CA-C-O 116.777 -2.124 . . . . 0.0 115.578 -175.441 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 22.2 t80 -36.42 133.13 0.54 Allowed 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 117.63 2.456 . . . . 0.0 117.63 -179.751 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 31.0 mtm -100.58 -57.78 2.04 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 123.065 0.546 . . . . 0.0 111.949 -177.005 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 523' ' ' PHE . . . . . 0.463 ' CE1' HG21 ' A' ' 549' ' ' VAL . 20.3 p90 -166.68 175.09 8.15 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 126.911 2.084 . . . . 0.0 112.46 -173.233 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 524' ' ' LYS . . . . . 0.498 ' HG2' HD23 ' A' ' 548' ' ' LEU . 66.6 mttt -107.35 162.69 13.68 Favored 'General case' 0 N--CA 1.476 0.867 0 O-C-N 120.169 -1.582 . . . . 0.0 112.178 168.629 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 5.1 m -133.33 162.5 39.68 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 C-N-CA 126.905 2.082 . . . . 0.0 109.768 164.057 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 42.5 tt0 -128.71 130.45 47.15 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-N 118.868 0.758 . . . . 0.0 111.924 169.305 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 527' ' ' ALA . . . . . 0.519 ' HA ' HG22 ' A' ' 589' ' ' THR . . . -60.92 127.36 31.18 Favored 'General case' 0 N--CA 1.466 0.353 0 O-C-N 121.124 -0.985 . . . . 0.0 111.548 -179.677 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 61.6 mm-40 -89.94 -25.45 20.92 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 125.308 1.443 . . . . 0.0 111.973 171.984 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 96.5 m-70 -142.44 163.77 31.94 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 126.974 2.109 . . . . 0.0 110.257 -172.944 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 35.8 m-20 -80.03 137.4 36.8 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 123.845 0.858 . . . . 0.0 111.726 177.474 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 89.2 t80 -134.36 121.3 20.99 Favored 'General case' 0 C--O 1.236 0.358 0 N-CA-C 114.065 1.135 . . . . 0.0 114.065 175.18 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -88.22 117.11 26.9 Favored 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 115.289 1.589 . . . . 0.0 115.289 173.701 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -67.77 123.68 21.2 Favored 'General case' 0 CA--C 1.537 0.468 0 O-C-N 121.898 -0.501 . . . . 0.0 110.902 171.336 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 6.2 t -115.9 -2.04 12.43 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 126.575 1.95 . . . . 0.0 114.242 -177.281 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 39.5 m-20 -113.73 156.56 23.58 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 125.713 1.605 . . . . 0.0 115.108 157.135 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 6.7 t -59.26 -29.09 67.31 Favored 'General case' 0 CA--C 1.545 0.785 0 N-CA-C 114.33 1.234 . . . . 0.0 114.33 170.584 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -70.42 -20.17 62.94 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 116.862 2.171 . . . . 0.0 116.862 169.467 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 82.1 mt-10 -85.05 149.93 25.22 Favored 'General case' 0 CA--C 1.542 0.651 0 O-C-N 120.671 -1.268 . . . . 0.0 113.95 -170.453 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -99.89 127.83 46.03 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 126.531 1.932 . . . . 0.0 110.663 179.134 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 14.1 tt0 -88.11 127.85 35.42 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 123.47 0.708 . . . . 0.0 111.473 -179.517 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 71.1 mt -119.34 140.7 49.91 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 124.58 1.152 . . . . 0.0 111.932 -177.426 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 14.4 tppt? -107.26 138.28 43.75 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 125.883 1.673 . . . . 0.0 109.063 164.649 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -49.57 114.32 1.02 Allowed 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.771 0.829 . . . . 0.0 110.872 175.173 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 107.52 -4.89 34.99 Favored Glycine 0 CA--C 1.534 1.238 0 C-N-CA 126.693 2.092 . . . . 0.0 114.677 -175.607 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 77.0 m-20 -70.0 120.46 15.75 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 119.734 1.767 . . . . 0.0 114.958 176.546 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 27.4 t -70.92 135.23 28.5 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 CA-C-N 118.539 0.609 . . . . 0.0 110.128 166.569 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 1.4 t -126.07 121.59 59.74 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.404 0 C-N-CA 125.547 1.539 . . . . 0.0 110.474 175.375 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 548' ' ' LEU . . . . . 0.498 HD23 ' HG2' ' A' ' 524' ' ' LYS . 30.6 mt -78.93 104.81 9.81 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 107.937 -1.135 . . . . 0.0 107.937 175.627 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 549' ' ' VAL . . . . . 0.463 HG21 ' CE1' ' A' ' 523' ' ' PHE . 30.9 t -61.03 131.71 26.14 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.901 0 CA-C-O 121.942 0.877 . . . . 0.0 113.17 170.743 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 5.6 pt -126.11 157.11 70.79 Favored Pre-proline 0 CA--C 1.542 0.672 0 C-N-CA 126.582 1.953 . . . . 0.0 108.504 175.936 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -66.62 145.89 77.51 Favored 'Trans proline' 0 N--CA 1.458 -0.595 0 C-N-CA 122.905 2.403 . . . . 0.0 110.74 176.147 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 32.8 m-85 -58.64 138.96 56.63 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 115.09 1.515 . . . . 0.0 115.09 177.912 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 553' ' ' GLN . . . . . . . . . . . . . 19.4 pt20 -66.2 -25.82 67.1 Favored 'General case' 0 N--CA 1.467 0.383 0 N-CA-C 113.627 0.973 . . . . 0.0 113.627 -177.43 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 58.2 m-20 -142.23 142.49 24.29 Favored Pre-proline 0 CA--C 1.544 0.725 0 C-N-CA 125.583 1.553 . . . . 0.0 110.293 167.497 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 555' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_endo -67.13 -34.39 28.48 Favored 'Trans proline' 0 CA--C 1.536 0.614 0 C-N-CA 123.671 2.914 . . . . 0.0 111.185 175.471 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 19.1 pt-20 -68.81 -14.11 62.82 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.91 1.284 . . . . 0.0 113.518 174.582 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 557' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -86.43 -21.45 27.09 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 114.145 1.165 . . . . 0.0 114.145 174.221 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 35.6 tt0 -66.21 121.91 16.27 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 113.37 0.878 . . . . 0.0 113.37 -174.628 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 66.5 m-20 -95.13 146.6 24.19 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 127.945 2.498 . . . . 0.0 113.277 176.999 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -81.55 133.9 35.44 Favored 'General case' 0 N--CA 1.472 0.664 0 O-C-N 120.364 -1.46 . . . . 0.0 113.349 -173.843 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 76.9 -1.02 64.22 Favored Glycine 0 CA--C 1.538 1.522 0 C-N-CA 124.025 0.822 . . . . 0.0 114.282 -169.841 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 57.9 m95 -97.07 158.71 15.3 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 125.859 1.663 . . . . 0.0 112.056 174.989 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -135.03 156.47 48.98 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 126.993 2.117 . . . . 0.0 109.486 176.884 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 51.5 ttm -119.01 141.28 48.82 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 124.285 1.034 . . . . 0.0 112.004 175.646 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -171.06 -172.08 36.93 Favored Glycine 0 CA--C 1.524 0.625 0 C-N-CA 123.817 0.722 . . . . 0.0 113.267 179.773 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 12.7 p -133.47 139.94 47.89 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 C-N-CA 126.23 1.812 . . . . 0.0 109.189 173.087 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 34.9 mtmt -57.24 136.61 56.49 Favored 'General case' 0 N--CA 1.469 0.479 0 O-C-N 121.086 -1.009 . . . . 0.0 111.308 175.865 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -60.59 -39.43 88.08 Favored 'General case' 0 CA--C 1.539 0.552 0 O-C-N 122.012 -0.43 . . . . 0.0 110.714 174.914 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 34.2 t -71.13 -14.16 62.19 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 113.911 1.078 . . . . 0.0 113.911 176.073 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 72.5 m-20 -83.68 -45.22 13.66 Favored 'General case' 0 CA--C 1.541 0.626 0 O-C-N 120.709 -1.244 . . . . 0.0 113.848 166.465 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 61.4 t-105 -71.39 -37.76 71.55 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.952 1.301 . . . . 0.0 114.293 179.377 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 7.0 t-20 -67.17 -13.8 62.3 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 124.808 1.243 . . . . 0.0 112.027 174.858 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 5.2 mm-40 -91.48 1.58 57.03 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 125.333 1.453 . . . . 0.0 114.395 171.217 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 48.1 m-70 60.11 35.25 21.24 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 125.275 1.43 . . . . 0.0 112.935 177.84 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 26.6 mtpp -91.58 163.19 14.22 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 125.943 1.697 . . . . 0.0 111.983 -175.829 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 10.7 pm0 -56.37 99.6 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 125.37 1.468 . . . . 0.0 114.618 -170.243 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 54.8 tp -56.22 -46.04 79.66 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 124.186 0.994 . . . . 0.0 111.718 -173.631 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 -62.73 -14.44 44.51 Favored 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 115.095 1.517 . . . . 0.0 115.095 -178.847 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 33.8 mmtp -112.48 -35.88 5.42 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.752 1.221 . . . . 0.0 113.321 175.205 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 83.0 m -67.04 -24.12 65.96 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.163 0.985 . . . . 0.0 112.297 175.517 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 17.3 ptt180 -68.49 149.75 48.89 Favored 'General case' 0 N--CA 1.47 0.526 0 N-CA-C 113.348 0.869 . . . . 0.0 113.348 175.057 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -164.44 172.59 40.25 Favored Glycine 0 CA--C 1.528 0.875 0 CA-C-N 114.598 -1.183 . . . . 0.0 113.917 174.255 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 28.4 m -92.31 143.48 11.28 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 C-N-CA 124.906 1.282 . . . . 0.0 112.108 170.339 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 45.8 p90 -138.6 154.56 73.37 Favored Pre-proline 0 CA--C 1.546 0.789 0 C-N-CA 124.786 1.234 . . . . 0.0 113.949 176.282 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -65.78 113.85 2.71 Favored 'Trans proline' 0 C--N 1.35 0.618 0 C-N-CA 122.924 2.416 . . . . 0.0 110.291 169.672 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 20.1 pt-20 -60.08 -26.0 65.84 Favored 'General case' 0 N--CA 1.479 1.002 0 O-C-N 121.493 -0.754 . . . . 0.0 112.203 -175.136 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 11.2 p-10 -71.92 -18.49 62.02 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 126.969 2.108 . . . . 0.0 113.799 -179.576 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 19.7 m-85 -72.23 -12.19 61.06 Favored 'General case' 0 N--CA 1.467 0.395 0 N-CA-C 116.276 1.954 . . . . 0.0 116.276 166.496 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 589' ' ' THR . . . . . 0.519 HG22 ' HA ' ' A' ' 527' ' ' ALA . 69.5 p -128.25 168.39 15.55 Favored 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 125.536 1.534 . . . . 0.0 110.658 -174.354 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 16.3 pt-20 -122.35 137.15 54.95 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 124.124 0.97 . . . . 0.0 109.976 174.798 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 15.3 tpp85 -64.32 131.58 47.69 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 124.706 1.202 . . . . 0.0 109.94 177.619 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 592' ' ' VAL . . . . . 0.435 HG23 ' HB2' ' A' ' 524' ' ' LYS . 2.9 m -126.4 156.86 72.09 Favored Pre-proline 0 N--CA 1.482 1.13 0 C-N-CA 125.645 1.578 . . . . 0.0 110.232 -177.545 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 593' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_endo . . . . . 0 C--O 1.252 1.202 0 C-N-CA 124.511 3.474 . . . . 0.0 113.954 -176.578 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B 1728 ' ' SER . . . . . . . . . . . . . 42.2 t . . . . . 0 N--CA 1.471 0.601 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B 1729 ' ' THR . . . . . . . . . . . . 0.28 1.4 p -64.9 -24.07 67.42 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 115.601 1.704 . . . . 0.0 115.601 172.031 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B 1730 ' ' VAL . . . . . . . . . . . . . 27.1 m -141.5 154.43 66.68 Favored Pre-proline 0 N--CA 1.478 0.974 0 C-N-CA 126.357 1.863 . . . . 0.0 111.18 -179.733 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 98.9 Cg_endo -71.68 167.11 27.42 Favored 'Trans proline' 0 CA--C 1.541 0.826 0 C-N-CA 122.809 2.339 . . . . 0.0 113.19 170.61 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 6.5 t -128.45 140.37 49.4 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.875 0 C-N-CA 126.153 1.781 . . . . 0.0 111.968 172.141 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -67.16 139.19 95.0 Favored Pre-proline 0 CA--C 1.55 0.965 0 O-C-N 121.518 -0.739 . . . . 0.0 112.835 -178.112 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -75.82 162.99 34.27 Favored 'Trans proline' 0 CA--C 1.543 0.967 0 C-N-CA 122.866 2.377 . . . . 0.0 113.204 -178.823 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 64.5 Cg_endo -69.23 149.14 69.91 Favored 'Trans proline' 0 CA--C 1.539 0.772 0 C-N-CA 123.602 2.868 . . . . 0.0 112.408 179.661 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B 1736 ' ' ARG . . . . . . . . . . . . . 56.6 mtp180 -112.53 149.59 32.48 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 126.31 1.844 . . . . 0.0 112.41 -178.514 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B 1737 ' ' ARG . . . . . . . . . . . . . 79.4 mtt180 -82.25 143.43 31.35 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 126.398 1.879 . . . . 0.0 111.665 -176.377 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B 1738 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.14 141.89 39.95 Favored 'General case' 0 N--CA 1.479 1.01 0 CA-C-O 121.097 0.475 . . . . 0.0 110.683 165.153 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B 1739 ' ' ARG . . . . . . . . . . . . . 81.4 mtt180 -106.02 160.9 14.94 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 126.238 1.815 . . . . 0.0 112.382 -172.241 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B 1740 ' ' GLY . . . . . . . . . . . . . . . 116.23 -3.43 20.48 Favored Glycine 0 CA--C 1.535 1.3 0 C-N-CA 124.936 1.255 . . . . 0.0 116.225 167.632 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B 1741 ' ' ARG . . . . . . . . . . . . . 29.5 ptt-85 -148.72 29.82 0.83 Allowed 'General case' 0 N--CA 1.484 1.234 0 CA-C-N 119.627 1.714 . . . . 0.0 113.828 171.227 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B 1742 ' ' ASN . . . . . . . . . . . . . 18.8 p-10 -102.01 161.48 13.65 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 126.039 1.736 . . . . 0.0 114.091 -177.328 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B 1743 ' ' LEU . . . . . . . . . . . . . 27.0 mt 64.92 28.94 12.59 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 127.261 2.224 . . . . 0.0 116.21 178.682 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B 1744 ' ' THR . . . . . . . . . . . . 0.351 0.2 OUTLIER . . . . . 0 N--CA 1.484 1.236 0 N-CA-C 119.088 2.995 . . . . 0.0 119.088 168.259 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 513' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.539 0 N-CA-C 112.023 -0.431 . . . . 0.0 112.023 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 514' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -108.65 172.74 6.66 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 125.921 1.688 . . . . 0.0 114.124 -171.148 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 67.0 mt -124.53 -17.65 5.94 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 125.736 1.614 . . . . 0.0 114.72 -164.495 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 516' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -107.94 155.3 20.46 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 127.416 2.287 . . . . 0.0 114.735 178.652 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 517' ' ' LEU . . . . . 0.456 HD22 HD22 ' A' ' 548' ' ' LEU . 10.8 mt -131.61 160.62 66.6 Favored Pre-proline 0 CA--C 1.542 0.642 0 C-N-CA 126.272 1.829 . . . . 0.0 111.69 -172.92 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -68.25 159.09 54.74 Favored 'Trans proline' 0 CA--C 1.54 0.795 0 C-N-CA 123.302 2.668 . . . . 0.0 114.025 -172.737 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -61.61 129.96 29.84 Favored 'Trans proline' 0 N--CA 1.458 -0.607 0 C-N-CA 123.609 2.873 . . . . 0.0 110.998 178.856 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 75.79 1.11 66.0 Favored Glycine 0 CA--C 1.536 1.405 0 CA-C-O 117.294 -1.836 . . . . 0.0 115.893 -177.203 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 30.4 t80 -37.18 128.87 0.95 Allowed 'General case' 0 C--N 1.349 0.578 0 N-CA-C 117.155 2.28 . . . . 0.0 117.155 -179.405 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 56.1 mtm -100.01 -53.87 3.04 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 123.943 0.897 . . . . 0.0 113.025 -177.876 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 523' ' ' PHE . . . . . 0.4 ' CE2' HG21 ' A' ' 549' ' ' VAL . 29.1 p90 -165.93 170.67 13.46 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 126.497 1.919 . . . . 0.0 112.974 -174.159 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 524' ' ' LYS . . . . . 0.523 ' HE2' ' CD2' ' A' ' 548' ' ' LEU . 80.0 mttt -101.86 161.98 13.26 Favored 'General case' 0 N--CA 1.467 0.394 0 O-C-N 121.131 -0.981 . . . . 0.0 112.148 168.189 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 15.3 m -132.84 162.82 39.33 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 C-N-CA 126.471 1.909 . . . . 0.0 109.691 164.987 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 55.5 tt0 -127.12 130.62 50.18 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 118.827 0.739 . . . . 0.0 111.548 170.04 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 527' ' ' ALA . . . . . . . . . . . . . . . -59.53 130.9 49.15 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 123.693 0.797 . . . . 0.0 111.359 176.246 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 31.7 mm-40 -93.9 -25.79 17.16 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.372 1.469 . . . . 0.0 110.604 168.585 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 62.7 m-70 -132.55 164.86 25.69 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 127.03 2.132 . . . . 0.0 111.903 -176.691 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -85.07 132.27 34.34 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 106.504 -1.665 . . . . 0.0 106.504 175.891 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 90.0 t80 -120.62 109.99 15.9 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 124.071 0.948 . . . . 0.0 113.134 172.093 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 1.2 m -84.93 108.16 17.43 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 115.178 1.547 . . . . 0.0 115.178 173.638 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -64.25 144.38 57.19 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 125.951 1.7 . . . . 0.0 112.707 178.99 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 2.2 t -125.43 11.35 8.02 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 126.864 2.066 . . . . 0.0 115.44 -177.067 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 28.4 t0 -143.69 157.54 44.33 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 125.808 1.643 . . . . 0.0 107.619 177.595 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 3.2 t -69.93 -21.33 63.29 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 114.681 1.363 . . . . 0.0 114.681 165.036 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 22.9 m-20 -73.46 -19.96 60.82 Favored 'General case' 0 CA--C 1.541 0.635 0 N-CA-C 115.105 1.52 . . . . 0.0 115.105 169.497 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 73.5 mt-10 -87.13 142.34 27.99 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 125.774 1.63 . . . . 0.0 114.553 -177.425 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -88.41 131.76 34.73 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 126.717 2.007 . . . . 0.0 110.035 174.763 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -85.28 133.9 34.14 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 123.614 0.765 . . . . 0.0 110.797 172.344 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 77.0 mt -124.86 147.92 48.53 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.586 1.154 . . . . 0.0 111.957 175.574 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 7.8 tmtt? -115.47 142.98 45.99 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 126.179 1.792 . . . . 0.0 108.147 164.899 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -48.0 123.75 6.63 Favored 'General case' 0 CA--C 1.544 0.735 0 CA-C-N 119.167 0.894 . . . . 0.0 111.068 177.083 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 95.26 0.65 63.11 Favored Glycine 0 CA--C 1.534 1.245 0 C-N-CA 125.477 1.513 . . . . 0.0 114.526 -177.45 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 81.9 m-20 -72.59 119.25 16.55 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 119.249 1.525 . . . . 0.0 113.645 176.107 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 3.4 t -71.89 137.13 24.26 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.573 0 O-C-N 122.126 -0.359 . . . . 0.0 111.321 169.585 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 1.4 t -129.1 124.5 60.78 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.544 0 C-N-CA 125.625 1.57 . . . . 0.0 111.57 177.753 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 548' ' ' LEU . . . . . 0.523 ' CD2' ' HE2' ' A' ' 524' ' ' LYS . 16.7 mt -82.48 99.8 9.69 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.883 1.273 . . . . 0.0 108.581 176.756 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 549' ' ' VAL . . . . . 0.4 HG21 ' CE2' ' A' ' 523' ' ' PHE . 5.1 t -63.41 132.79 29.35 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.198 0 N-CA-C 114.692 1.367 . . . . 0.0 114.692 175.333 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 11.3 pt -129.22 156.55 78.15 Favored Pre-proline 0 CA--C 1.548 0.901 0 C-N-CA 127.09 2.156 . . . . 0.0 110.002 177.765 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -75.39 148.91 34.42 Favored 'Trans proline' 0 CA--C 1.534 0.513 0 C-N-CA 123.918 3.078 . . . . 0.0 112.058 175.678 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 552' ' ' PHE . . . . . 0.445 ' CE1' ' HA ' ' A' ' 558' ' ' GLN . 14.9 m-85 -74.55 143.78 44.34 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 114.368 1.248 . . . . 0.0 114.368 179.163 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 553' ' ' GLN . . . . . . . . . . . . . 17.7 pm0 -62.45 -25.44 67.98 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 125.787 1.635 . . . . 0.0 115.031 175.027 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 9.8 m-20 -150.45 150.27 28.42 Favored Pre-proline 0 CA--C 1.536 0.423 0 C-N-CA 125.215 1.406 . . . . 0.0 112.298 -176.63 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 555' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -66.77 -35.63 27.03 Favored 'Trans proline' 0 CA--C 1.537 0.645 0 C-N-CA 123.091 2.527 . . . . 0.0 112.061 177.153 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -72.86 -24.99 60.94 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.254 1.205 . . . . 0.0 114.254 175.138 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 557' ' ' GLU . . . . . . . . . . . . . 67.6 mm-40 -73.36 -22.53 60.26 Favored 'General case' 0 N--CA 1.473 0.714 0 O-C-N 121.451 -0.781 . . . . 0.0 112.624 171.61 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 558' ' ' GLN . . . . . 0.445 ' HA ' ' CE1' ' A' ' 552' ' ' PHE . 29.9 tt0 -78.57 153.43 31.21 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 124.432 1.093 . . . . 0.0 112.276 173.132 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -142.31 144.41 33.23 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 125.83 1.652 . . . . 0.0 114.746 -179.702 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 39.0 tp10 -68.39 129.53 40.19 Favored 'General case' 0 CA--C 1.537 0.449 0 O-C-N 121.382 -0.824 . . . . 0.0 111.934 -176.526 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 83.31 -6.77 70.63 Favored Glycine 0 CA--C 1.537 1.428 0 C-N-CA 124.76 1.172 . . . . 0.0 114.436 -175.06 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 61.9 m95 -93.09 160.81 14.69 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 125.08 1.352 . . . . 0.0 112.688 174.63 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 14.0 mt -138.08 153.44 49.3 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 126.047 1.739 . . . . 0.0 109.332 168.712 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 54.4 ttm -109.69 143.51 39.37 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 124.184 0.993 . . . . 0.0 111.277 173.54 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -172.45 -171.84 37.68 Favored Glycine 0 CA--C 1.522 0.479 0 C-N-CA 123.699 0.666 . . . . 0.0 112.758 176.907 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 12.0 p -131.77 138.68 52.26 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.503 0 C-N-CA 125.03 1.332 . . . . 0.0 108.65 171.434 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 35.5 mtmt -59.18 136.71 58.04 Favored 'General case' 0 N--CA 1.467 0.404 0 O-C-N 121.272 -0.892 . . . . 0.0 110.759 178.119 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -59.19 -41.86 89.51 Favored 'General case' 0 C--O 1.219 -0.542 0 CA-C-O 117.906 -1.045 . . . . 0.0 110.37 175.654 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 38.0 t -62.39 -33.66 75.2 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 120.247 1.385 . . . . 0.0 112.467 176.781 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 77.8 m-20 -69.16 -43.9 73.37 Favored 'General case' 0 CA--C 1.542 0.666 0 N-CA-C 115.488 1.662 . . . . 0.0 115.488 173.402 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 65.7 t-105 -72.01 -31.62 66.39 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.606 1.562 . . . . 0.0 113.203 175.671 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 46.7 t-20 -76.32 -24.12 54.29 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 127.603 2.361 . . . . 0.0 111.893 172.085 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 81.2 mt-30 -80.8 -3.82 52.42 Favored 'General case' 0 CA--C 1.544 0.733 0 O-C-N 120.961 -1.087 . . . . 0.0 113.213 163.29 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 88.2 m-70 61.12 32.64 19.62 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 125.998 1.719 . . . . 0.0 113.755 171.769 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 74.3 mttt -70.03 160.48 31.89 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.711 1.604 . . . . 0.0 111.696 175.432 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 9.2 pm0 -56.29 111.59 1.01 Allowed 'General case' 0 CA--C 1.549 0.937 0 N-CA-C 113.383 0.882 . . . . 0.0 113.383 176.997 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 45.5 tp -57.54 -49.48 76.21 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 124.254 1.022 . . . . 0.0 112.872 -169.8 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 65.8 mm-40 -66.19 -16.51 64.05 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 113.828 1.047 . . . . 0.0 113.828 -174.378 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 18.3 tptm -97.34 -44.78 6.74 Favored 'General case' 0 N--CA 1.465 0.322 0 C-N-CA 125.249 1.42 . . . . 0.0 112.05 174.148 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 56.5 m -76.67 -17.09 59.33 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 114.927 1.454 . . . . 0.0 114.927 -177.153 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 7.9 ptt85 -63.33 160.12 16.61 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 123.807 0.843 . . . . 0.0 112.544 169.05 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -169.14 174.5 43.61 Favored Glycine 0 CA--C 1.526 0.775 0 CA-C-N 115.564 -0.744 . . . . 0.0 113.641 170.418 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 31.3 m -91.01 139.88 16.92 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.382 0 C-N-CA 124.706 1.203 . . . . 0.0 111.164 168.274 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 41.8 p90 -135.64 154.7 78.33 Favored Pre-proline 0 CA--C 1.539 0.55 0 C-N-CA 124.831 1.253 . . . . 0.0 112.152 174.808 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -68.38 114.44 3.46 Favored 'Trans proline' 0 CA--C 1.535 0.558 0 C-N-CA 122.103 1.869 . . . . 0.0 110.103 170.66 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 15.4 pt-20 -54.02 -30.63 48.35 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.835 0.854 . . . . 0.0 112.617 -179.22 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 7.3 p-10 -70.03 -18.08 63.28 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 127.041 2.137 . . . . 0.0 113.481 -177.432 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 19.6 m-85 -72.4 -11.08 60.53 Favored 'General case' 0 CA--C 1.536 0.409 0 N-CA-C 116.442 2.016 . . . . 0.0 116.442 163.507 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 589' ' ' THR . . . . . . . . . . . . . 34.2 p -125.29 178.42 5.6 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 126.331 1.852 . . . . 0.0 112.675 -175.902 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -131.43 140.1 49.54 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 125.458 1.503 . . . . 0.0 110.089 169.983 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -64.11 114.19 4.01 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 124.767 1.227 . . . . 0.0 109.855 171.68 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 592' ' ' VAL . . . . . 0.52 HG23 ' HB2' ' A' ' 524' ' ' LYS . 1.3 m -95.74 155.69 38.2 Favored Pre-proline 0 N--CA 1.478 0.952 0 C-N-CA 125.308 1.443 . . . . 0.0 108.977 176.99 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 593' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo . . . . . 0 C--O 1.253 1.236 0 C-N-CA 124.076 3.184 . . . . 0.0 113.103 -178.445 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B 1728 ' ' SER . . . . . . . . . . . . . 28.8 t . . . . . 0 N--CA 1.48 1.028 0 N-CA-C 112.632 0.605 . . . . 0.0 112.632 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B 1729 ' ' THR . . . . . . . . . . . . . 1.7 p -76.43 -11.14 59.84 Favored 'General case' 0 N--CA 1.48 1.051 0 N-CA-C 116.863 2.171 . . . . 0.0 116.863 -171.514 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B 1730 ' ' VAL . . . . . . . . . . . . . 4.5 m -53.49 150.31 12.87 Favored Pre-proline 0 N--CA 1.475 0.776 0 C-N-CA 125.614 1.565 . . . . 0.0 113.675 177.001 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -64.34 166.21 17.79 Favored 'Trans proline' 0 CA--C 1.54 0.799 0 C-N-CA 123.058 2.505 . . . . 0.0 112.95 176.624 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 3.5 t -134.62 131.71 54.09 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 C-N-CA 125.276 1.431 . . . . 0.0 112.443 -178.087 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -68.52 133.43 90.91 Favored Pre-proline 0 CA--C 1.548 0.897 0 O-C-N 121.443 -0.786 . . . . 0.0 111.491 -176.321 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -78.58 165.13 25.37 Favored 'Trans proline' 0 CA--C 1.548 1.186 0 C-N-CA 122.982 2.455 . . . . 0.0 113.088 -178.334 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -60.53 144.93 99.57 Favored 'Trans proline' 0 CA--C 1.539 0.735 0 C-N-CA 123.533 2.822 . . . . 0.0 114.028 179.263 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B 1736 ' ' ARG . . . . . . . . . . . . . 49.3 mtp180 -115.58 160.37 20.07 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 126.153 1.781 . . . . 0.0 111.27 174.742 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B 1737 ' ' ARG . . . . . . . . . . . . . 58.9 mtt180 -73.24 170.38 15.12 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 124.692 1.197 . . . . 0.0 112.969 176.117 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B 1738 ' ' ARG . . . . . . . . . . . . . 28.4 ptt-85 -125.69 38.51 4.15 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 127.049 2.14 . . . . 0.0 112.553 -174.007 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B 1739 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.28 169.58 2.1 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 127.083 2.153 . . . . 0.0 115.302 -170.125 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B 1740 ' ' GLY . . . . . . . . . . . . . . . 80.16 -39.86 2.3 Favored Glycine 0 CA--C 1.531 1.06 0 N-CA-C 116.827 1.491 . . . . 0.0 116.827 164.412 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B 1741 ' ' ARG . . . . . . . . . . . . . 74.6 mtm180 55.16 66.57 1.19 Allowed 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 125.623 1.569 . . . . 0.0 113.749 179.539 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B 1742 ' ' ASN . . . . . . . . . . . . . 3.8 m120 -74.45 158.28 34.13 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 124.923 1.289 . . . . 0.0 111.884 174.97 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B 1743 ' ' LEU . . . . . . . . . . . . . 82.9 mt -111.12 -11.84 14.22 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.332 1.453 . . . . 0.0 114.761 -178.433 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B 1744 ' ' THR . . . . . . . . . . . . . 3.4 t . . . . . 0 N--CA 1.483 1.215 0 N-CA-C 115.643 1.72 . . . . 0.0 115.643 -175.841 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 513' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.941 0 N-CA-C 111.568 -0.613 . . . . 0.0 111.568 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 514' ' ' ARG . . . . . . . . . . . . . 34.6 mmt180 -104.79 168.35 9.12 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 125.292 1.437 . . . . 0.0 112.47 172.622 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 96.4 mt -95.76 -39.18 9.99 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 124.201 1.0 . . . . 0.0 111.663 171.796 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 516' ' ' ASP . . . . . . . . . . . . . 23.6 t0 -79.63 139.16 37.53 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-O 123.157 1.456 . . . . 0.0 108.583 175.406 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 517' ' ' LEU . . . . . 0.477 HD22 HD22 ' A' ' 548' ' ' LEU . 13.4 mt -123.2 158.95 56.55 Favored Pre-proline 0 C--N 1.324 -0.523 0 C-N-CA 125.987 1.715 . . . . 0.0 110.526 -175.679 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_endo -65.01 160.95 39.04 Favored 'Trans proline' 0 CA--C 1.538 0.695 0 C-N-CA 122.846 2.364 . . . . 0.0 113.484 -173.253 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -58.17 135.4 68.09 Favored 'Trans proline' 0 N--CA 1.46 -0.5 0 C-N-CA 122.893 2.396 . . . . 0.0 110.541 176.911 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 69.9 0.77 28.58 Favored Glycine 0 CA--C 1.535 1.308 0 CA-C-O 117.357 -1.802 . . . . 0.0 115.893 -178.677 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 34.7 t80 -36.29 125.28 0.79 Allowed 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 121.057 2.428 . . . . 0.0 116.814 -178.538 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 63.0 mtm -98.92 -53.31 3.31 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 123.344 0.658 . . . . 0.0 112.344 -177.15 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 523' ' ' PHE . . . . . . . . . . . . . 26.8 p90 -164.39 169.14 17.75 Favored 'General case' 0 C--O 1.223 -0.318 0 C-N-CA 126.332 1.853 . . . . 0.0 112.834 -174.093 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 524' ' ' LYS . . . . . 0.562 ' HE2' ' CD2' ' A' ' 548' ' ' LEU . 87.9 mttt -100.83 163.12 12.46 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 122.219 1.009 . . . . 0.0 111.253 166.938 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 17.3 m -135.45 161.6 38.9 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 C-N-CA 126.248 1.819 . . . . 0.0 109.016 165.92 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 58.0 tt0 -124.54 130.02 51.68 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 118.39 0.541 . . . . 0.0 111.877 169.848 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 527' ' ' ALA . . . . . 0.417 ' HA ' HG22 ' A' ' 589' ' ' THR . . . -59.59 124.13 19.1 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.988 0.915 . . . . 0.0 111.95 177.341 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 75.6 mm-40 -87.94 -25.74 23.05 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.127 1.371 . . . . 0.0 112.298 173.769 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 59.0 m-70 -139.2 167.81 21.24 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 127.177 2.191 . . . . 0.0 109.221 178.522 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 10.6 p-10 -85.22 138.81 32.11 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 125.071 1.348 . . . . 0.0 114.512 174.609 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 89.7 t80 -133.12 107.55 8.28 Favored 'General case' 0 C--O 1.235 0.299 0 C-N-CA 125.09 1.356 . . . . 0.0 111.803 179.198 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 532' ' ' THR . . . . . . . . . . . . 0.251 0.6 OUTLIER -81.61 104.55 12.1 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 113.697 0.999 . . . . 0.0 113.697 170.884 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -59.7 133.05 55.74 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 125.337 1.455 . . . . 0.0 110.895 176.986 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 4.4 t -109.1 -10.48 15.0 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.618 1.567 . . . . 0.0 115.047 -171.935 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 12.3 m-20 -133.45 153.36 51.68 Favored 'General case' 0 N--CA 1.463 0.209 0 C-N-CA 126.38 1.872 . . . . 0.0 115.745 176.929 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 536' ' ' THR . . . . . . . . . . . . 0.252 1.3 t -62.43 -27.42 69.1 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 116.582 2.067 . . . . 0.0 116.582 -171.301 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 87.2 m-20 -72.54 -17.49 61.72 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 116.407 2.002 . . . . 0.0 116.407 171.13 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 82.6 mt-10 -82.27 149.78 27.63 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.383 1.473 . . . . 0.0 114.243 -177.343 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -97.89 128.71 44.66 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 126.638 1.975 . . . . 0.0 110.422 177.651 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 15.3 tt0 -86.15 127.81 34.78 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 123.613 0.765 . . . . 0.0 111.549 178.495 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 76.9 mt -122.43 143.97 49.34 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 124.7 1.2 . . . . 0.0 112.295 -178.992 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 6.6 tmtm? -115.78 147.42 40.99 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 126.23 1.812 . . . . 0.0 109.329 169.717 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -54.12 120.49 6.52 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-O 121.993 0.901 . . . . 0.0 110.888 -179.613 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 100.47 0.79 55.56 Favored Glycine 0 CA--C 1.529 0.917 0 C-N-CA 125.381 1.467 . . . . 0.0 114.756 -178.481 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 80.8 m-20 -70.86 122.59 20.21 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 119.303 1.552 . . . . 0.0 113.77 -179.516 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 58.7 t -69.9 133.99 30.9 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.614 0 N-CA-C 109.198 -0.668 . . . . 0.0 109.198 166.93 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -126.69 124.16 64.47 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.503 0 C-N-CA 124.794 1.238 . . . . 0.0 111.41 171.757 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 548' ' ' LEU . . . . . 0.562 ' CD2' ' HE2' ' A' ' 524' ' ' LYS . 20.0 mt -80.13 100.07 8.06 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.547 1.139 . . . . 0.0 108.477 175.621 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 549' ' ' VAL . . . . . . . . . . . . . 4.1 t -63.51 132.0 29.23 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.224 0 N-CA-C 114.688 1.366 . . . . 0.0 114.688 173.837 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 17.0 pt -128.12 155.65 77.68 Favored Pre-proline 0 CA--C 1.544 0.739 0 C-N-CA 126.54 1.936 . . . . 0.0 110.435 179.186 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -70.52 152.77 65.6 Favored 'Trans proline' 0 N--CA 1.459 -0.53 0 C-N-CA 123.548 2.832 . . . . 0.0 110.619 171.329 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 52.2 m-85 -69.86 140.47 53.22 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 115.792 1.775 . . . . 0.0 115.792 -176.706 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 553' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -66.32 -14.4 61.98 Favored 'General case' 0 CA--C 1.542 0.673 0 N-CA-C 115.352 1.612 . . . . 0.0 115.352 173.846 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 4.0 m-20 -161.09 154.48 18.19 Favored Pre-proline 0 CA--C 1.543 0.701 0 C-N-CA 126.007 1.723 . . . . 0.0 111.105 171.061 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 555' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_endo -67.99 -34.59 22.72 Favored 'Trans proline' 0 CA--C 1.542 0.881 0 C-N-CA 123.398 2.732 . . . . 0.0 112.058 175.002 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -66.72 -24.13 66.2 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 113.665 0.987 . . . . 0.0 113.665 172.541 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 557' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -73.62 -19.12 60.95 Favored 'General case' 0 CA--C 1.542 0.644 0 O-C-N 120.546 -1.346 . . . . 0.0 113.469 175.312 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 40.1 tt0 -83.73 143.21 30.17 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 125.362 1.465 . . . . 0.0 113.669 -179.527 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 25.7 m-20 -127.43 149.65 49.99 Favored 'General case' 0 CA--C 1.553 1.079 0 C-N-CA 125.411 1.485 . . . . 0.0 110.8 -178.141 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -70.77 120.25 16.09 Favored 'General case' 0 N--CA 1.477 0.905 0 O-C-N 120.637 -1.289 . . . . 0.0 112.813 -170.331 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 83.68 -0.11 89.67 Favored Glycine 0 CA--C 1.54 1.636 0 C-N-CA 124.422 1.01 . . . . 0.0 115.275 -173.754 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 53.8 m95 -90.34 164.71 14.23 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 125.285 1.434 . . . . 0.0 113.437 176.102 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 11.4 mt -134.06 161.23 35.43 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 125.256 1.422 . . . . 0.0 110.517 165.657 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 55.8 ttm -116.01 145.91 42.58 Favored 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 124.853 1.261 . . . . 0.0 112.018 171.59 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -172.56 -169.44 35.2 Favored Glycine 0 CA--C 1.525 0.673 0 C-N-CA 124.402 1.001 . . . . 0.0 112.434 178.073 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 14.7 p -136.6 141.57 40.62 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 C-N-CA 125.731 1.612 . . . . 0.0 109.461 173.636 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 37.1 mtmt -58.07 135.22 56.96 Favored 'General case' 0 N--CA 1.469 0.518 0 O-C-N 121.138 -0.976 . . . . 0.0 110.788 174.967 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 19.5 tt0 -60.76 -39.0 87.16 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 119.636 -0.826 . . . . 0.0 110.186 174.273 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 47.3 t -58.09 -37.36 74.36 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 124.293 1.037 . . . . 0.0 112.427 177.15 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 -74.19 -44.28 54.01 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 114.959 1.466 . . . . 0.0 114.959 175.861 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 60.3 t-105 -67.67 -32.29 72.86 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.589 1.156 . . . . 0.0 112.975 176.562 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 26.7 t-20 -66.48 -35.66 80.83 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 126.414 1.886 . . . . 0.0 112.278 174.221 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 75.5 mt-30 -75.9 -5.7 47.36 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 125.566 1.546 . . . . 0.0 113.649 175.241 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 95.8 m-70 56.43 48.16 17.44 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 125.136 1.374 . . . . 0.0 112.66 -178.123 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 26.9 mttp -75.76 162.25 28.35 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 124.961 1.305 . . . . 0.0 111.778 166.533 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 14.1 pm0 -63.88 103.14 0.54 Allowed 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.379 1.072 . . . . 0.0 112.747 177.761 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 32.4 tp -58.31 -35.56 72.05 Favored 'General case' 0 CA--C 1.537 0.449 0 O-C-N 121.212 -0.93 . . . . 0.0 111.903 -174.515 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -65.08 -16.06 63.05 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 124.59 1.156 . . . . 0.0 113.885 -179.17 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 32.1 mmtp -114.28 -39.98 3.76 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 125.585 1.554 . . . . 0.0 112.442 177.623 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 39.1 m -70.51 -24.83 62.9 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 114.221 1.193 . . . . 0.0 114.221 177.063 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 17.3 ptp180 -62.01 160.97 11.46 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-N 118.91 0.777 . . . . 0.0 111.777 169.104 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -173.49 172.44 45.2 Favored Glycine 0 CA--C 1.521 0.468 0 CA-C-N 115.401 -0.818 . . . . 0.0 114.078 175.823 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 31.9 m -89.35 139.19 17.83 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.387 0 C-N-CA 124.282 1.033 . . . . 0.0 111.374 169.738 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 40.7 p90 -133.6 154.8 80.88 Favored Pre-proline 0 CA--C 1.541 0.628 0 C-N-CA 124.62 1.168 . . . . 0.0 112.889 173.381 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -65.61 110.75 1.7 Allowed 'Trans proline' 0 C--N 1.346 0.436 0 C-N-CA 122.039 1.826 . . . . 0.0 109.275 168.658 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 17.5 pt-20 -57.51 -26.93 62.07 Favored 'General case' 0 N--CA 1.474 0.744 0 O-C-N 121.506 -0.746 . . . . 0.0 112.32 -176.799 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 13.3 p-10 -71.51 -12.45 61.38 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 127.063 2.145 . . . . 0.0 114.64 178.278 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 18.4 m-85 -74.31 -13.74 60.8 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 116.862 2.171 . . . . 0.0 116.862 163.731 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 589' ' ' THR . . . . . 0.417 HG22 ' HA ' ' A' ' 527' ' ' ALA . 58.7 p -122.63 173.21 7.86 Favored 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 125.671 1.588 . . . . 0.0 111.893 -174.222 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -127.72 136.41 51.5 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 123.916 0.887 . . . . 0.0 109.691 171.731 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -64.33 120.09 11.55 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 125.567 1.547 . . . . 0.0 109.221 178.579 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 592' ' ' VAL . . . . . 0.524 HG23 ' HB2' ' A' ' 524' ' ' LYS . 2.3 m -102.39 148.16 35.04 Favored Pre-proline 0 N--CA 1.476 0.86 0 C-N-CA 124.944 1.298 . . . . 0.0 108.329 177.539 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 593' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo . . . . . 0 C--O 1.254 1.287 0 C-N-CA 124.493 3.462 . . . . 0.0 114.649 -165.014 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B 1728 ' ' SER . . . . . . . . . . . . . 10.8 t . . . . . 0 N--CA 1.477 0.898 0 N-CA-C 109.6 -0.518 . . . . 0.0 109.6 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B 1729 ' ' THR . . . . . . . . . . . . 0.463 0.6 OUTLIER 65.52 11.79 7.69 Favored 'General case' 0 N--CA 1.481 1.109 0 N-CA-C 117.874 2.546 . . . . 0.0 117.874 178.537 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B 1730 ' ' VAL . . . . . . . . . . . . . 19.2 m -136.66 151.74 73.23 Favored Pre-proline 0 N--CA 1.479 0.979 0 C-N-CA 125.754 1.622 . . . . 0.0 113.172 -177.321 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 88.9 Cg_endo -73.62 163.81 36.47 Favored 'Trans proline' 0 CA--C 1.539 0.771 0 C-N-CA 124.294 3.329 . . . . 0.0 112.612 169.908 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 4.0 p -140.26 147.35 23.49 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 C-N-CA 125.958 1.703 . . . . 0.0 109.301 170.948 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -72.34 141.55 83.42 Favored Pre-proline 0 CA--C 1.554 1.101 0 N-CA-C 113.401 0.889 . . . . 0.0 113.401 -173.641 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -79.12 168.54 20.34 Favored 'Trans proline' 0 CA--C 1.552 1.396 0 C-N-CA 123.451 2.767 . . . . 0.0 113.378 178.061 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 35.9 Cg_exo -63.98 157.72 51.38 Favored 'Trans proline' 0 CA--C 1.539 0.729 0 C-N-CA 124.217 3.278 . . . . 0.0 114.19 -179.694 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B 1736 ' ' ARG . . . . . . . . . . . . . 28.8 mtm180 -135.17 158.11 45.21 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 125.33 1.452 . . . . 0.0 112.176 -160.769 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B 1737 ' ' ARG . . . . . . . . . . . . . 36.5 mmt180 -145.13 87.17 1.8 Allowed 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 125.886 1.674 . . . . 0.0 112.569 -172.633 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B 1738 ' ' ARG . . . . . . . . . . . . . 7.7 mmp_? -62.51 146.48 51.59 Favored 'General case' 0 N--CA 1.481 1.115 0 O-C-N 121.035 -1.041 . . . . 0.0 111.817 175.031 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B 1739 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.89 171.65 4.24 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 125.323 1.449 . . . . 0.0 113.936 -167.423 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B 1740 ' ' GLY . . . . . . . . . . . . . . . 100.09 159.76 28.37 Favored Glycine 0 CA--C 1.537 1.43 0 C-N-CA 124.942 1.258 . . . . 0.0 113.43 -170.343 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B 1741 ' ' ARG . . . . . . . . . . . . . 12.7 mmp_? -75.07 -13.15 60.46 Favored 'General case' 0 N--CA 1.482 1.136 0 N-CA-C 115.898 1.814 . . . . 0.0 115.898 -165.422 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B 1742 ' ' ASN . . . . . . . . . . . . . 93.2 m-20 -100.5 126.03 46.88 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 124.363 1.065 . . . . 0.0 111.935 168.51 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B 1743 ' ' LEU . . . . . . . . . . . . . 10.8 mp -105.09 126.87 52.55 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 125.537 1.535 . . . . 0.0 109.876 170.822 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B 1744 ' ' THR . . . . . . . . . . . . . 6.8 p . . . . . 0 C--O 1.251 1.16 0 C-N-CA 126.581 1.952 . . . . 0.0 114.098 175.978 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 513' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.91 0 N-CA-C 111.137 -0.785 . . . . 0.0 111.137 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 514' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -77.7 172.94 12.64 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 125.397 1.479 . . . . 0.0 113.618 174.229 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 71.9 mt -85.76 -39.43 17.16 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.51 1.524 . . . . 0.0 112.5 172.915 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 516' ' ' ASP . . . . . . . . . . . . . 42.4 t0 -159.09 171.47 19.91 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 126.529 1.931 . . . . 0.0 108.306 -173.845 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 517' ' ' LEU . . . . . 0.422 HD22 HD22 ' A' ' 548' ' ' LEU . 10.3 mt -83.56 162.55 52.94 Favored Pre-proline 0 CA--C 1.55 0.973 0 C-N-CA 124.999 1.32 . . . . 0.0 111.249 164.304 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -66.43 161.51 40.66 Favored 'Trans proline' 0 CA--C 1.538 0.709 0 C-N-CA 123.477 2.785 . . . . 0.0 114.287 -173.759 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -61.19 128.53 25.41 Favored 'Trans proline' 0 N--CA 1.459 -0.519 0 C-N-CA 123.244 2.63 . . . . 0.0 111.098 -179.4 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 73.03 6.84 69.22 Favored Glycine 0 CA--C 1.534 1.257 0 CA-C-O 117.453 -1.748 . . . . 0.0 116.238 -178.116 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 35.1 t80 -37.88 135.68 0.63 Allowed 'General case' 0 CA--C 1.547 0.865 0 CA-C-N 120.852 2.326 . . . . 0.0 117.134 -179.997 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 60.8 mtm -109.26 -51.5 2.87 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.448 0.699 . . . . 0.0 112.832 -179.099 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 523' ' ' PHE . . . . . . . . . . . . . 23.7 p90 -165.54 167.41 17.45 Favored 'General case' 0 C--O 1.223 -0.314 0 C-N-CA 125.984 1.713 . . . . 0.0 114.018 -174.018 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 524' ' ' LYS . . . . . 0.581 ' HB2' HG23 ' A' ' 592' ' ' VAL . 69.6 mttt -99.7 164.05 12.22 Favored 'General case' 0 N--CA 1.47 0.535 0 O-C-N 121.389 -0.819 . . . . 0.0 111.664 166.312 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 17.8 m -139.45 156.12 26.38 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.975 0 C-N-CA 126.952 2.101 . . . . 0.0 109.007 167.685 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 63.8 tt0 -119.01 128.88 54.79 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 119.157 0.889 . . . . 0.0 112.007 170.912 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 527' ' ' ALA . . . . . 0.459 ' HA ' HG22 ' A' ' 589' ' ' THR . . . -60.26 117.82 5.65 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.708 1.203 . . . . 0.0 111.726 176.434 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 65.4 mm-40 -81.44 -26.36 35.4 Favored 'General case' 0 CA--C 1.537 0.442 0 C-N-CA 124.741 1.217 . . . . 0.0 111.076 170.58 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 45.0 m80 -138.11 164.27 29.55 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 125.36 1.464 . . . . 0.0 112.476 -175.441 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . 0.253 1.7 p30 -77.41 132.33 38.45 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 115.015 1.487 . . . . 0.0 115.015 176.305 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 79.2 t80 -137.82 122.1 18.17 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 113.728 1.011 . . . . 0.0 113.728 176.707 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -87.44 125.14 34.11 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 114.665 1.357 . . . . 0.0 114.665 175.071 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -66.56 129.7 40.71 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-O 121.122 0.486 . . . . 0.0 110.851 169.561 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 4.6 p -97.9 -36.02 10.3 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 126.496 1.918 . . . . 0.0 113.777 171.436 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 96.4 m-20 -95.09 156.44 16.32 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 125.262 1.425 . . . . 0.0 114.642 176.197 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 7.7 t -54.99 -29.48 57.25 Favored 'General case' 0 N--CA 1.472 0.625 0 N-CA-C 114.665 1.357 . . . . 0.0 114.665 164.822 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 90.8 m-20 -104.97 6.13 33.26 Favored 'General case' 0 CA--C 1.544 0.726 0 N-CA-C 115.353 1.612 . . . . 0.0 115.353 175.867 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 57.3 mt-10 -86.19 152.11 23.09 Favored 'General case' 0 CA--C 1.541 0.621 0 O-C-N 120.392 -1.443 . . . . 0.0 111.103 165.0 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -101.87 132.92 47.37 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.92 1.288 . . . . 0.0 111.201 -176.294 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 29.1 tt0 -82.91 127.93 33.97 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 123.999 0.919 . . . . 0.0 109.941 174.354 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 85.0 mt -130.34 139.98 50.65 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 125.234 1.413 . . . . 0.0 111.696 -179.248 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 3.7 tmtt? -110.07 145.93 36.24 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 125.716 1.607 . . . . 0.0 110.048 168.085 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -54.54 96.06 0.01 OUTLIER 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 124.527 1.131 . . . . 0.0 112.085 173.113 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 134.01 -10.71 4.8 Favored Glycine 0 CA--C 1.536 1.377 0 C-N-CA 126.948 2.213 . . . . 0.0 114.717 -175.72 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 79.8 m-20 -77.88 127.35 32.25 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 114.962 1.467 . . . . 0.0 114.962 -170.272 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 1.9 t -77.27 135.94 25.45 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.827 0 N-CA-C 113.235 0.828 . . . . 0.0 113.235 167.899 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 1.4 t -124.59 121.91 62.55 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.358 0 C-N-CA 125.97 1.708 . . . . 0.0 110.996 175.843 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 548' ' ' LEU . . . . . 0.447 HD23 ' HG2' ' A' ' 524' ' ' LYS . 18.4 mt -77.22 101.98 6.45 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 108.212 -1.033 . . . . 0.0 108.212 172.202 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 549' ' ' VAL . . . . . . . . . . . . . 7.5 t -64.25 133.58 29.71 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.23 0 N-CA-C 114.548 1.314 . . . . 0.0 114.548 173.694 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 14.9 pt -130.2 159.27 71.2 Favored Pre-proline 0 CA--C 1.544 0.735 0 C-N-CA 126.728 2.011 . . . . 0.0 109.595 -178.348 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -71.1 141.72 40.47 Favored 'Trans proline' 0 C--O 1.24 0.62 0 C-N-CA 123.16 2.573 . . . . 0.0 111.83 175.848 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 45.4 m-85 -56.71 143.2 37.35 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 115.179 1.548 . . . . 0.0 115.179 166.455 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 553' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -59.45 -24.52 63.62 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 113.873 1.064 . . . . 0.0 113.873 175.188 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -161.83 152.28 14.54 Favored Pre-proline 0 CA--C 1.546 0.826 0 C-N-CA 124.855 1.262 . . . . 0.0 112.825 176.465 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 555' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -72.7 -25.17 17.54 Favored 'Trans proline' 0 CA--C 1.539 0.741 0 C-N-CA 124.195 3.263 . . . . 0.0 113.777 -177.644 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 21.7 pt-20 -70.16 -30.74 67.96 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.83 0.852 . . . . 0.0 112.36 169.34 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 557' ' ' GLU . . . . . . . . . . . . . 71.4 mm-40 -76.42 -29.21 56.95 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 124.725 1.21 . . . . 0.0 112.772 179.154 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 40.7 tt0 -66.24 120.92 14.09 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 124.604 1.162 . . . . 0.0 112.503 177.756 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 53.6 m-20 -85.31 142.3 29.44 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.884 1.274 . . . . 0.0 112.529 171.987 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 52.6 tp10 -78.36 131.81 37.14 Favored 'General case' 0 N--CA 1.469 0.512 0 O-C-N 120.292 -1.505 . . . . 0.0 111.368 -170.36 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 80.61 -4.05 71.0 Favored Glycine 0 CA--C 1.537 1.442 0 O-C-N 121.636 -0.665 . . . . 0.0 114.37 -173.133 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 47.5 m95 -89.75 165.27 14.27 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.21 1.404 . . . . 0.0 112.654 172.721 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 14.4 mt -134.87 154.82 51.5 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 125.545 1.538 . . . . 0.0 110.004 167.663 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 35.8 tpp -110.68 142.24 42.85 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 125.188 1.395 . . . . 0.0 110.863 171.651 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -165.07 -174.62 34.96 Favored Glycine 0 CA--C 1.526 0.744 0 O-C-N 121.336 -0.852 . . . . 0.0 113.561 174.922 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 13.0 p -130.62 139.71 50.58 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 C-N-CA 125.026 1.33 . . . . 0.0 108.8 169.341 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 36.3 mtmt -57.07 137.05 56.29 Favored 'General case' 0 N--CA 1.467 0.375 0 O-C-N 121.4 -0.813 . . . . 0.0 111.36 176.205 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 47.5 tt0 -60.96 -38.9 87.52 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-O 118.411 -0.804 . . . . 0.0 111.126 178.44 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 61.8 m -68.96 -31.91 71.12 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 119.504 1.047 . . . . 0.0 113.495 175.934 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 -65.57 -42.71 91.49 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 122.473 1.13 . . . . 0.0 113.924 170.057 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 46.9 t-105 -78.05 -27.58 48.75 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.668 1.187 . . . . 0.0 113.832 178.803 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 5.3 t-20 -67.04 -34.05 76.86 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 119.724 1.147 . . . . 0.0 110.98 173.922 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 39.3 mt-30 -73.83 -11.0 60.24 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 113.909 1.077 . . . . 0.0 113.909 165.492 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 68.7 m-70 56.68 38.44 29.54 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.434 1.494 . . . . 0.0 113.339 -178.252 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 62.5 mttt -60.82 162.82 6.31 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 125.221 1.409 . . . . 0.0 112.52 172.051 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -48.49 95.41 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 126.947 2.099 . . . . 0.0 113.867 174.786 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 49.9 tp -52.85 -47.8 67.52 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 125.801 1.64 . . . . 0.0 111.933 -169.744 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -63.33 -20.7 65.73 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 125.333 1.453 . . . . 0.0 114.601 -175.166 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 32.7 mmtp -102.73 -43.35 5.6 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.288 1.035 . . . . 0.0 111.756 176.218 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 62.1 m -63.22 -30.94 71.99 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 113.907 1.077 . . . . 0.0 113.907 176.48 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 2.7 ptt85 -62.57 166.1 5.65 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-O 122.32 1.057 . . . . 0.0 113.151 175.498 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -177.94 171.0 43.48 Favored Glycine 0 CA--C 1.524 0.646 0 CA-C-N 114.22 -1.355 . . . . 0.0 113.275 170.975 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 31.7 m -87.44 145.27 7.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 C-N-CA 124.983 1.313 . . . . 0.0 110.394 171.098 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 44.2 p90 -141.23 155.37 68.06 Favored Pre-proline 0 C--O 1.24 0.579 0 C-N-CA 124.115 0.966 . . . . 0.0 113.285 175.652 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -66.82 108.56 1.49 Allowed 'Trans proline' 0 N--CA 1.458 -0.561 0 C-N-CA 122.245 1.963 . . . . 0.0 109.489 169.515 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 17.7 pt-20 -55.5 -27.64 49.82 Favored 'General case' 0 N--CA 1.475 0.776 0 O-C-N 121.457 -0.777 . . . . 0.0 112.588 -177.533 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 11.5 p-10 -67.13 -21.66 65.82 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 125.967 1.707 . . . . 0.0 113.872 178.177 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 13.4 m-85 -68.53 -15.35 63.51 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 116.412 2.004 . . . . 0.0 116.412 166.407 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 589' ' ' THR . . . . . 0.459 HG22 ' HA ' ' A' ' 527' ' ' ALA . 62.7 p -120.62 174.85 6.31 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 126.065 1.746 . . . . 0.0 111.18 -177.473 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -135.64 139.77 44.02 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.886 0.874 . . . . 0.0 109.802 171.986 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -61.13 134.2 56.8 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 126.851 2.06 . . . . 0.0 112.157 -177.573 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 592' ' ' VAL . . . . . 0.581 HG23 ' HB2' ' A' ' 524' ' ' LYS . 3.5 m -130.86 149.43 73.65 Favored Pre-proline 0 CA--C 1.546 0.806 0 C-N-CA 124.169 0.988 . . . . 0.0 109.854 177.295 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 593' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo . . . . . 0 C--O 1.254 1.276 1 C-N-CA 125.395 4.064 . . . . 0.0 113.106 -177.472 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B 1728 ' ' SER . . . . . . . . . . . . . 47.2 t . . . . . 0 N--CA 1.475 0.784 0 CA-C-O 120.851 0.358 . . . . 0.0 110.992 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B 1729 ' ' THR . . . . . . . . . . . . 0.265 0.2 OUTLIER -101.76 -11.45 19.1 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 116.558 2.058 . . . . 0.0 116.558 -171.538 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B 1730 ' ' VAL . . . . . . . . . . . . . 2.9 m -73.58 139.72 78.07 Favored Pre-proline 0 N--CA 1.472 0.662 0 C-N-CA 124.019 0.928 . . . . 0.0 112.243 165.848 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 78.9 Cg_endo -74.83 166.32 29.54 Favored 'Trans proline' 0 CA--C 1.539 0.754 0 C-N-CA 123.675 2.916 . . . . 0.0 113.616 -179.136 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 47.0 t -136.28 134.62 49.95 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.94 0 C-N-CA 126.294 1.837 . . . . 0.0 109.643 178.925 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -67.52 142.56 96.37 Favored Pre-proline 0 CA--C 1.551 0.991 0 N-CA-C 112.882 0.697 . . . . 0.0 112.882 -173.551 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -73.71 162.13 40.3 Favored 'Trans proline' 0 CA--C 1.539 0.731 0 C-N-CA 122.762 2.308 . . . . 0.0 111.861 176.385 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -63.67 164.14 22.19 Favored 'Trans proline' 0 CA--C 1.539 0.76 0 C-N-CA 122.812 2.341 . . . . 0.0 112.179 178.676 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B 1736 ' ' ARG . . . . . . . . . . . . . 79.2 mtp180 -123.51 151.57 42.66 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 126.06 1.744 . . . . 0.0 109.688 177.98 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B 1737 ' ' ARG . . . . . . . . . . . . . 25.0 mmm180 -73.5 176.95 5.65 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 126.08 1.752 . . . . 0.0 113.406 -160.406 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B 1738 ' ' ARG . . . . . . . . . . . . . 75.1 mtt180 -61.3 -34.93 76.03 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 124.143 0.977 . . . . 0.0 113.202 172.538 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B 1739 ' ' ARG . . . . . . . . . . . . . 33.9 ttt85 -70.85 128.49 36.18 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 123.56 0.744 . . . . 0.0 111.554 169.103 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B 1740 ' ' GLY . . . . . . . . . . . . . . . 149.79 -173.76 29.45 Favored Glycine 0 CA--C 1.534 1.246 0 C-N-CA 125.0 1.286 . . . . 0.0 112.173 -171.54 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B 1741 ' ' ARG . . . . . . . . . . . . . 20.2 ttp85 -82.87 -0.01 46.21 Favored 'General case' 0 N--CA 1.484 1.263 0 N-CA-C 114.014 1.116 . . . . 0.0 114.014 -178.251 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B 1742 ' ' ASN . . . . . . . . . . . . . 9.5 p-10 -57.59 139.44 53.54 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.056 1.342 . . . . 0.0 112.136 169.839 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B 1743 ' ' LEU . . . . . . . . . . . . . 1.7 pt? -86.33 140.2 30.27 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 123.884 0.874 . . . . 0.0 112.218 177.313 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B 1744 ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.485 1.309 0 N-CA-C 116.518 2.044 . . . . 0.0 116.518 179.964 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 513' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.379 0 N-CA-C 112.138 -0.385 . . . . 0.0 112.138 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 514' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -66.28 157.64 31.07 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 125.122 1.369 . . . . 0.0 114.258 178.592 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -79.37 -29.88 42.34 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.535 1.534 . . . . 0.0 112.619 166.798 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 516' ' ' ASP . . . . . . . . . . . . . 18.5 p30 -123.75 153.91 40.24 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 115.53 1.678 . . . . 0.0 115.53 -178.963 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 10.0 mt -121.61 160.52 46.05 Favored Pre-proline 0 CA--C 1.544 0.718 0 C-N-CA 125.79 1.636 . . . . 0.0 112.343 -174.004 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -66.91 160.39 47.2 Favored 'Trans proline' 0 CA--C 1.538 0.695 0 C-N-CA 123.755 2.97 . . . . 0.0 113.581 -173.774 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -63.99 135.67 48.84 Favored 'Trans proline' 0 N--CA 1.456 -0.732 0 C-N-CA 123.135 2.557 . . . . 0.0 109.787 178.997 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 70.6 1.57 38.29 Favored Glycine 0 CA--C 1.535 1.314 0 CA-C-O 116.693 -2.17 . . . . 0.0 116.306 -176.299 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 30.5 t80 -35.61 135.84 0.26 Allowed 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 117.573 2.434 . . . . 0.0 117.573 -178.631 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 44.9 mtm -103.99 -64.64 1.08 Allowed 'General case' 0 C--O 1.237 0.406 0 C-N-CA 123.271 0.628 . . . . 0.0 111.595 179.872 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 523' ' ' PHE . . . . . 0.437 ' CE2' HG21 ' A' ' 549' ' ' VAL . 41.6 p90 -158.78 174.55 14.85 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 124.781 1.232 . . . . 0.0 112.881 -175.39 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 524' ' ' LYS . . . . . 0.539 ' HE2' ' CD2' ' A' ' 548' ' ' LEU . 78.8 mttt -108.0 160.93 15.4 Favored 'General case' 0 N--CA 1.472 0.661 0 O-C-N 121.173 -0.954 . . . . 0.0 112.593 173.524 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 16.7 m -136.5 159.7 37.86 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 C-N-CA 126.698 1.999 . . . . 0.0 109.926 167.385 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 60.7 tt0 -122.55 130.88 53.5 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 124.031 0.932 . . . . 0.0 112.591 169.749 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 527' ' ' ALA . . . . . 0.424 ' HA ' HG22 ' A' ' 589' ' ' THR . . . -63.44 121.42 13.78 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.753 1.221 . . . . 0.0 112.613 178.289 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 60.6 mm-40 -84.32 -22.75 30.53 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.345 1.458 . . . . 0.0 111.986 172.974 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 52.7 m80 -142.72 161.88 36.93 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 126.418 1.887 . . . . 0.0 111.135 -168.672 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -87.8 123.39 32.54 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.981 1.712 . . . . 0.0 115.344 -179.729 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 78.2 t80 -130.56 113.45 14.25 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 124.33 1.052 . . . . 0.0 112.148 -176.241 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 1.2 m -89.33 127.07 35.76 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 124.636 1.175 . . . . 0.0 114.075 169.561 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -74.13 132.12 41.95 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-O 122.545 1.165 . . . . 0.0 112.778 -173.912 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 534' ' ' THR . . . . . . . . . . . . 0.289 3.3 t -108.97 14.88 23.82 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 126.214 1.806 . . . . 0.0 114.624 -177.928 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 24.9 t0 -150.7 159.34 44.58 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.86 1.264 . . . . 0.0 108.074 175.837 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 1.4 t -72.54 -10.43 59.78 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 115.01 1.485 . . . . 0.0 115.01 167.45 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 95.4 m-20 -76.64 -25.24 53.6 Favored 'General case' 0 N--CA 1.47 0.547 0 N-CA-C 116.379 1.992 . . . . 0.0 116.379 162.968 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 70.6 mt-10 -87.17 153.64 21.35 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 114.229 1.196 . . . . 0.0 114.229 -166.598 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -100.04 129.35 46.08 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 126.91 2.084 . . . . 0.0 110.051 176.549 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 18.4 tt0 -80.43 130.27 35.05 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.474 0.709 . . . . 0.0 110.198 173.183 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 78.2 mt -124.58 146.64 48.93 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 124.771 1.229 . . . . 0.0 111.067 176.721 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -116.77 149.21 40.3 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 124.474 1.11 . . . . 0.0 109.403 167.071 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -54.29 105.91 0.17 Allowed 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 123.233 0.613 . . . . 0.0 111.753 176.097 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 121.31 -8.64 10.32 Favored Glycine 0 CA--C 1.534 1.25 0 C-N-CA 126.678 2.085 . . . . 0.0 114.1 -177.826 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 84.6 m-20 -78.91 123.91 27.73 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 119.414 1.607 . . . . 0.0 114.757 -172.679 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 2.4 t -73.17 138.8 20.62 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 C-N-CA 123.74 0.816 . . . . 0.0 112.049 171.816 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -129.13 124.69 61.11 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.41 0 C-N-CA 125.192 1.397 . . . . 0.0 111.594 176.567 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 548' ' ' LEU . . . . . 0.539 ' CD2' ' HE2' ' A' ' 524' ' ' LYS . 17.3 mt -81.23 98.27 8.02 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.568 1.147 . . . . 0.0 108.134 176.252 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 549' ' ' VAL . . . . . 0.437 HG21 ' CE2' ' A' ' 523' ' ' PHE . 3.0 t -57.74 125.05 13.12 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.111 0 N-CA-C 113.548 0.944 . . . . 0.0 113.548 169.579 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 6.0 pt -122.76 157.53 59.51 Favored Pre-proline 0 N--CA 1.473 0.722 0 C-N-CA 126.641 1.976 . . . . 0.0 108.981 178.437 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -63.83 149.62 90.29 Favored 'Trans proline' 0 N--CA 1.461 -0.41 0 C-N-CA 122.635 2.223 . . . . 0.0 110.272 173.863 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 552' ' ' PHE . . . . . 0.426 ' CE1' ' HA ' ' A' ' 558' ' ' GLN . 29.3 m-85 -66.1 137.48 57.08 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 116.188 1.921 . . . . 0.0 116.188 179.699 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 553' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -67.09 -21.36 65.87 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 115.191 1.552 . . . . 0.0 115.191 -176.172 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 6.4 m-20 -160.09 154.59 20.4 Favored Pre-proline 0 CA--C 1.547 0.832 0 C-N-CA 125.384 1.474 . . . . 0.0 110.881 177.392 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 555' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -69.95 -29.66 22.63 Favored 'Trans proline' 0 CA--C 1.538 0.699 0 C-N-CA 123.938 3.092 . . . . 0.0 112.891 178.127 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 3.1 pt-20 -72.04 -16.32 62.04 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 113.395 0.887 . . . . 0.0 113.395 170.627 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 557' ' ' GLU . . . . . . . . . . . . . 53.2 mm-40 -90.0 -15.51 31.74 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 124.91 1.284 . . . . 0.0 113.965 -178.591 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 558' ' ' GLN . . . . . 0.426 ' HA ' ' CE1' ' A' ' 552' ' ' PHE . 40.6 tt0 -89.07 132.14 34.91 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 125.471 1.508 . . . . 0.0 113.782 -179.49 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -125.93 144.26 50.76 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 125.005 1.322 . . . . 0.0 108.665 -170.954 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -77.64 129.9 36.16 Favored 'General case' 0 N--CA 1.475 0.782 0 O-C-N 120.205 -1.559 . . . . 0.0 112.666 -171.35 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 81.41 -0.42 87.84 Favored Glycine 0 CA--C 1.539 1.543 0 C-N-CA 124.37 0.986 . . . . 0.0 114.703 -172.967 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 54.0 m95 -102.59 162.69 12.73 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 126.789 2.036 . . . . 0.0 112.508 175.14 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 11.1 mt -138.74 154.86 48.57 Favored 'General case' 0 N--CA 1.472 0.655 0 O-C-N 121.146 -0.971 . . . . 0.0 110.894 172.864 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 48.3 ttm -112.79 139.88 48.04 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 124.983 1.313 . . . . 0.0 111.718 -179.164 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -170.08 -174.77 38.52 Favored Glycine 0 CA--C 1.522 0.528 0 C-N-CA 124.292 0.948 . . . . 0.0 112.732 178.264 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 13.8 p -128.24 140.29 49.6 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.493 0 C-N-CA 125.48 1.512 . . . . 0.0 109.118 170.416 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 36.3 mtmt -59.89 136.17 57.92 Favored 'General case' 0 N--CA 1.465 0.317 0 O-C-N 121.459 -0.775 . . . . 0.0 111.056 176.694 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -57.94 -40.55 80.78 Favored 'General case' 0 C--O 1.22 -0.453 0 CA-C-O 118.096 -0.954 . . . . 0.0 110.558 176.927 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 52.3 m -59.32 -44.05 92.63 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 119.903 1.228 . . . . 0.0 113.017 175.11 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -62.64 -35.2 78.85 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 115.336 1.606 . . . . 0.0 115.336 173.465 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 69.6 t-105 -79.54 -31.86 42.13 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.63 1.172 . . . . 0.0 113.332 175.476 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 21.8 t-20 -71.69 -30.23 65.45 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 126.332 1.853 . . . . 0.0 111.845 177.913 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 50.6 mt-30 -83.11 3.49 30.45 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 114.022 1.119 . . . . 0.0 114.022 171.127 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 55.3 m-70 57.93 30.18 18.74 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 126.316 1.846 . . . . 0.0 114.148 178.963 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 45.5 mttt -68.01 161.54 26.41 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 124.838 1.255 . . . . 0.0 111.351 174.296 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 20.0 pt-20 -56.4 105.92 0.24 Allowed 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 124.654 1.181 . . . . 0.0 114.122 -177.64 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 42.5 tp -54.39 -48.86 71.06 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 125.094 1.357 . . . . 0.0 112.14 -173.827 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 21.1 pm0 -59.05 -18.83 38.39 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 126.301 1.84 . . . . 0.0 114.974 -177.508 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 66.7 mmtt -124.74 -8.68 7.31 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 115.606 1.706 . . . . 0.0 115.606 177.403 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 97.9 m -80.16 -32.34 38.82 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 123.984 0.914 . . . . 0.0 112.27 163.422 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 36.4 ptt180 -61.61 157.12 18.17 Favored 'General case' 0 N--CA 1.474 0.733 0 O-C-N 121.378 -0.826 . . . . 0.0 112.724 174.944 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -170.2 174.86 44.3 Favored Glycine 0 CA--C 1.524 0.634 0 C-N-CA 124.643 1.116 . . . . 0.0 113.139 174.996 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 21.5 m -93.77 142.67 12.96 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 C-N-CA 124.553 1.141 . . . . 0.0 111.682 169.427 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 38.9 p90 -136.18 154.48 77.36 Favored Pre-proline 0 CA--C 1.539 0.525 0 C-N-CA 125.057 1.343 . . . . 0.0 112.863 176.699 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -66.21 112.85 2.43 Favored 'Trans proline' 0 N--CA 1.457 -0.65 0 C-N-CA 121.62 1.547 . . . . 0.0 108.845 169.57 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 22.1 pt-20 -52.73 -33.35 47.62 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 123.265 0.626 . . . . 0.0 111.821 -179.37 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 9.8 p-10 -69.99 -10.84 60.01 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 127.473 2.309 . . . . 0.0 114.636 -178.637 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 16.5 m-85 -77.24 -11.68 59.86 Favored 'General case' 0 N--CA 1.468 0.466 0 N-CA-C 116.82 2.155 . . . . 0.0 116.82 162.199 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 589' ' ' THR . . . . . 0.424 HG22 ' HA ' ' A' ' 527' ' ' ALA . 67.8 p -129.82 170.47 13.84 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 125.992 1.717 . . . . 0.0 111.779 -174.272 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -131.36 137.49 48.76 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 124.162 0.985 . . . . 0.0 110.74 175.985 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 12.9 tpt180 -56.98 135.12 56.21 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 126.366 1.866 . . . . 0.0 112.023 177.388 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 592' ' ' VAL . . . . . 0.52 HG23 ' HB2' ' A' ' 524' ' ' LYS . 2.1 m -130.29 153.55 81.27 Favored Pre-proline 0 N--CA 1.481 1.084 0 C-N-CA 125.975 1.71 . . . . 0.0 109.304 176.13 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 593' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo . . . . . 0 C--O 1.251 1.166 0 C-N-CA 124.364 3.376 . . . . 0.0 115.479 -167.462 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B 1728 ' ' SER . . . . . . . . . . . . . 45.6 m . . . . . 0 N--CA 1.479 0.986 0 N-CA-C 112.209 0.448 . . . . 0.0 112.209 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B 1729 ' ' THR . . . . . . . . . . . . 0.439 0.6 OUTLIER 57.11 36.38 27.51 Favored 'General case' 0 N--CA 1.482 1.133 0 N-CA-C 116.375 1.991 . . . . 0.0 116.375 177.158 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B 1730 ' ' VAL . . . . . . . . . . . . . 1.5 m -77.61 145.68 71.76 Favored Pre-proline 0 N--CA 1.474 0.744 0 N-CA-C 114.72 1.378 . . . . 0.0 114.72 -173.685 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -69.68 168.25 22.0 Favored 'Trans proline' 0 CA--C 1.539 0.761 0 C-N-CA 124.003 3.135 . . . . 0.0 114.459 179.522 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 65.6 t -129.86 133.82 64.07 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.842 0 C-N-CA 126.268 1.827 . . . . 0.0 109.709 177.379 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -68.51 132.22 91.29 Favored Pre-proline 0 CA--C 1.549 0.912 0 O-C-N 121.651 -0.655 . . . . 0.0 111.887 179.764 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -75.78 167.0 27.19 Favored 'Trans proline' 0 CA--C 1.544 0.979 0 C-N-CA 122.134 1.889 . . . . 0.0 112.019 -177.503 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 73.8 Cg_exo -50.4 151.85 9.35 Favored 'Trans proline' 0 C--N 1.347 0.5 0 C-N-CA 124.012 3.141 . . . . 0.0 112.654 169.931 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B 1736 ' ' ARG . . . . . . . . . . . . . 1.2 ptm180 -162.73 129.52 3.56 Favored 'General case' 0 N--CA 1.466 0.355 0 C-N-CA 124.227 1.011 . . . . 0.0 112.221 172.274 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B 1737 ' ' ARG . . . . . . . . . . . . . 2.3 ptm180 -47.82 155.67 0.39 Allowed 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 127.192 2.197 . . . . 0.0 113.298 166.891 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B 1738 ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -132.65 151.62 51.91 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 124.959 1.303 . . . . 0.0 112.577 -176.206 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B 1739 ' ' ARG . . . . . . . . . . . . . 2.4 mpp_? -90.14 149.25 22.53 Favored 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 115.257 1.577 . . . . 0.0 115.257 -161.039 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B 1740 ' ' GLY . . . . . . . . . . . . . . . -86.65 -160.63 34.9 Favored Glycine 0 CA--C 1.535 1.304 0 C-N-CA 125.06 1.315 . . . . 0.0 112.963 167.207 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B 1741 ' ' ARG . . . . . . . . . . . . . 12.0 mmp_? -59.83 120.79 10.25 Favored 'General case' 0 N--CA 1.479 0.992 0 O-C-N 121.54 -0.976 . . . . 0.0 111.417 174.276 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B 1742 ' ' ASN . . . . . . . . . . . . . 4.8 m-20 -84.45 93.26 8.26 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.363 0.665 . . . . 0.0 110.366 171.031 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B 1743 ' ' LEU . . . . . . . . . . . . . 56.3 tp -64.95 106.94 1.35 Allowed 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 124.183 0.993 . . . . 0.0 110.442 179.858 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B 1744 ' ' THR . . . . . . . . . . . . 0.279 1.4 m . . . . . 0 C--O 1.251 1.172 0 C-N-CA 125.847 1.659 . . . . 0.0 114.029 -171.109 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 513' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 1.007 0 N-CA-C 110.917 -0.873 . . . . 0.0 110.917 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 514' ' ' ARG . . . . . . . . . . . . . 4.9 mmp_? -84.89 161.01 20.02 Favored 'General case' 0 N--CA 1.483 1.219 0 N-CA-C 114.64 1.348 . . . . 0.0 114.64 -174.787 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 64.7 tp -98.81 -42.75 7.05 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.724 1.61 . . . . 0.0 111.691 169.019 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 516' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -74.79 136.08 41.68 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 124.595 1.158 . . . . 0.0 113.997 174.515 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 517' ' ' LEU . . . . . 0.482 HD22 HD22 ' A' ' 548' ' ' LEU . 10.4 mt -128.0 155.77 77.24 Favored Pre-proline 0 CA--C 1.537 0.475 0 C-N-CA 125.585 1.554 . . . . 0.0 112.445 -169.617 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -65.52 158.22 54.17 Favored 'Trans proline' 0 CA--C 1.537 0.674 0 C-N-CA 123.882 3.055 . . . . 0.0 113.756 -169.482 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -62.2 133.42 43.61 Favored 'Trans proline' 0 N--CA 1.456 -0.733 0 C-N-CA 123.306 2.671 . . . . 0.0 109.809 177.705 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 75.13 3.17 68.52 Favored Glycine 0 CA--C 1.534 1.247 0 CA-C-O 117.73 -1.594 . . . . 0.0 115.432 -175.347 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 37.2 t80 -42.6 125.55 3.34 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 121.024 2.412 . . . . 0.0 116.21 178.951 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 60.5 mtm -97.06 -47.76 5.66 Favored 'General case' 0 N--CA 1.471 0.575 0 C-N-CA 123.782 0.833 . . . . 0.0 112.546 -177.195 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 523' ' ' PHE . . . . . 0.442 ' CE1' HG21 ' A' ' 549' ' ' VAL . 23.8 p90 -171.15 167.19 7.15 Favored 'General case' 0 C--O 1.223 -0.321 0 C-N-CA 128.177 2.591 . . . . 0.0 112.504 -176.404 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 524' ' ' LYS . . . . . 0.562 ' HG2' HD23 ' A' ' 548' ' ' LEU . 85.1 mttt -96.9 160.71 14.2 Favored 'General case' 0 N--CA 1.47 0.539 0 O-C-N 120.871 -1.143 . . . . 0.0 111.653 165.365 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 16.4 m -133.09 161.36 41.69 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 C-N-CA 125.334 1.453 . . . . 0.0 109.959 163.18 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 43.8 tt0 -128.33 128.92 45.49 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 124.009 0.923 . . . . 0.0 111.875 174.841 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 527' ' ' ALA . . . . . 0.545 ' HA ' HG22 ' A' ' 589' ' ' THR . . . -62.83 123.52 18.69 Favored 'General case' 0 CA--C 1.538 0.484 0 O-C-N 121.547 -0.721 . . . . 0.0 111.576 -178.584 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 42.3 mm-40 -87.24 -32.96 19.48 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 124.785 1.234 . . . . 0.0 110.044 168.888 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 97.6 m-70 -130.54 153.66 48.62 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 126.54 1.936 . . . . 0.0 110.798 179.039 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -79.42 141.6 36.69 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 125.276 1.43 . . . . 0.0 113.182 176.566 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 86.4 t80 -134.0 128.2 33.88 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 115.397 1.629 . . . . 0.0 115.397 -174.974 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -92.9 112.13 23.98 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 116.268 1.951 . . . . 0.0 116.268 177.983 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -67.7 130.69 43.78 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 123.835 0.854 . . . . 0.0 111.026 171.81 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 534' ' ' THR . . . . . . . . . . . . 0.259 12.1 t -136.39 31.23 2.89 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 125.946 1.698 . . . . 0.0 112.694 179.739 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 41.1 t0 -146.66 169.99 17.87 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 125.086 1.354 . . . . 0.0 109.056 167.364 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 1.1 t -67.6 -26.77 66.43 Favored 'General case' 0 N--CA 1.47 0.536 0 N-CA-C 115.871 1.804 . . . . 0.0 115.871 168.048 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 35.6 t0 -76.51 -27.71 56.13 Favored 'General case' 0 CA--C 1.547 0.852 0 O-C-N 121.069 -1.02 . . . . 0.0 110.887 178.363 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 60.3 mt-10 -80.76 149.29 29.71 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 115.404 1.631 . . . . 0.0 115.404 -164.596 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -101.62 137.88 39.35 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 128.967 2.907 . . . . 0.0 109.866 174.506 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 19.9 tt0 -95.47 134.95 37.73 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 123.994 0.917 . . . . 0.0 111.064 175.892 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 80.1 mt -125.68 148.1 49.13 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.388 1.075 . . . . 0.0 112.647 -178.189 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 3.1 tppp? -113.57 141.31 47.33 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 126.85 2.06 . . . . 0.0 109.497 164.491 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -52.47 114.02 1.24 Allowed 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 119.025 0.829 . . . . 0.0 110.982 173.575 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 115.61 -15.41 17.18 Favored Glycine 0 CA--C 1.529 0.936 0 C-N-CA 126.024 1.773 . . . . 0.0 113.463 -173.161 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 78.3 m-20 -66.83 118.63 10.61 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 118.953 1.377 . . . . 0.0 113.873 -178.037 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 45.9 t -72.53 134.75 29.22 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 166.791 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -127.49 123.08 60.82 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.386 0 C-N-CA 125.856 1.662 . . . . 0.0 111.184 175.86 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 548' ' ' LEU . . . . . 0.562 HD23 ' HG2' ' A' ' 524' ' ' LYS . 22.3 mt -81.39 98.84 8.39 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.894 1.278 . . . . 0.0 108.393 178.438 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 549' ' ' VAL . . . . . 0.442 HG21 ' CE1' ' A' ' 523' ' ' PHE . 3.4 t -62.43 131.97 27.98 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.236 0 N-CA-C 114.772 1.397 . . . . 0.0 114.772 175.812 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 18.2 pt -133.24 158.24 76.23 Favored Pre-proline 0 CA--C 1.551 1.011 0 C-N-CA 127.134 2.173 . . . . 0.0 109.935 177.859 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 82.8 Cg_endo -71.16 154.51 62.01 Favored 'Trans proline' 0 CA--C 1.537 0.626 0 C-N-CA 124.031 3.154 . . . . 0.0 112.016 174.639 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 24.5 m-85 -67.18 159.58 28.71 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 116.747 2.129 . . . . 0.0 116.747 -174.728 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 553' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -65.75 -24.7 67.01 Favored 'General case' 0 N--CA 1.476 0.827 0 O-C-N 121.127 -0.983 . . . . 0.0 113.222 172.584 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 53.5 m-20 -157.99 150.76 18.15 Favored Pre-proline 0 CA--C 1.544 0.712 0 C-N-CA 126.421 1.888 . . . . 0.0 111.538 177.977 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 555' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -66.46 -35.45 30.4 Favored 'Trans proline' 0 CA--C 1.539 0.772 0 C-N-CA 123.107 2.538 . . . . 0.0 111.406 168.39 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 23.8 pt-20 -71.08 -9.12 57.51 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.423 1.489 . . . . 0.0 114.108 172.306 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 557' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 -97.07 -25.63 15.28 Favored 'General case' 0 N--CA 1.478 0.942 0 O-C-N 121.123 -0.986 . . . . 0.0 113.561 166.961 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 42.7 tt0 -65.53 118.72 9.87 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 124.023 0.929 . . . . 0.0 113.053 -177.448 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 50.6 m-20 -90.84 128.65 36.81 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 126.012 1.725 . . . . 0.0 110.886 -179.246 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 6.0 tm-20 -65.04 135.1 55.19 Favored 'General case' 0 N--CA 1.475 0.814 0 O-C-N 120.358 -1.464 . . . . 0.0 111.608 -178.701 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 80.51 -5.72 63.42 Favored Glycine 0 CA--C 1.538 1.524 0 C-N-CA 124.25 0.928 . . . . 0.0 115.229 -174.651 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 48.0 m95 -93.95 167.15 11.79 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 125.199 1.4 . . . . 0.0 112.87 172.846 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 16.8 mt -134.36 160.15 38.83 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 124.49 1.116 . . . . 0.0 110.328 165.177 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 38.1 ttm -114.77 143.45 45.06 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 124.976 1.31 . . . . 0.0 111.307 175.503 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -170.58 -172.5 36.99 Favored Glycine 0 CA--C 1.523 0.586 0 CA-C-O 121.687 0.604 . . . . 0.0 113.304 176.288 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 14.5 p -132.54 136.91 55.29 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 C-N-CA 125.595 1.558 . . . . 0.0 109.214 173.226 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 40.4 mtmt -62.86 137.85 58.38 Favored 'General case' 0 N--CA 1.465 0.318 0 O-C-N 121.085 -1.009 . . . . 0.0 111.805 178.758 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 71.2 tt0 -58.04 -44.89 87.64 Favored 'General case' 0 C--O 1.222 -0.356 0 CA-C-O 118.268 -0.872 . . . . 0.0 110.866 -178.15 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 10.5 t -63.92 -26.5 68.62 Favored 'General case' 0 CA--C 1.546 0.79 0 CA-C-N 119.735 1.152 . . . . 0.0 112.983 -177.427 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -72.84 -48.23 39.49 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 126.69 1.996 . . . . 0.0 109.452 175.951 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 64.6 t-105 -67.64 -30.3 69.82 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.443 1.497 . . . . 0.0 113.003 176.154 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 33.8 t-20 -76.17 -25.68 55.48 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 127.009 2.124 . . . . 0.0 112.202 175.869 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 32.0 mt-30 -80.1 3.22 21.12 Favored 'General case' 0 CA--C 1.546 0.797 0 N-CA-C 113.375 0.88 . . . . 0.0 113.375 160.351 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 95.0 m-70 54.38 34.43 20.73 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 126.241 1.816 . . . . 0.0 114.491 175.697 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 5.6 mtpm? -75.05 158.17 33.61 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 125.289 1.436 . . . . 0.0 111.758 178.092 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 8.1 pm0 -53.18 108.83 0.36 Allowed 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.738 1.615 . . . . 0.0 114.37 -176.707 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 64.0 tp -57.0 -47.29 81.19 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 125.197 1.399 . . . . 0.0 112.945 -170.041 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 56.6 mt-10 -68.13 -24.07 64.97 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 114.488 1.292 . . . . 0.0 114.488 -174.852 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 43.1 mmtm -85.52 -47.05 10.27 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 123.618 0.767 . . . . 0.0 111.816 168.692 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 89.5 m -67.45 -28.53 67.96 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 114.381 1.252 . . . . 0.0 114.381 -172.13 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 36.2 ptt180 -64.63 163.27 14.07 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 124.635 1.174 . . . . 0.0 113.505 175.428 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -171.63 172.9 44.85 Favored Glycine 0 CA--C 1.531 1.057 0 C-N-CA 125.092 1.33 . . . . 0.0 114.27 174.449 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 14.7 m -91.67 143.97 10.2 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.61 0 C-N-CA 125.522 1.529 . . . . 0.0 112.639 170.847 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 49.3 p90 -142.25 155.59 64.69 Favored Pre-proline 0 CA--C 1.545 0.778 0 C-N-CA 124.876 1.27 . . . . 0.0 112.91 176.98 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_endo -69.08 110.3 2.38 Favored 'Trans proline' 0 C--N 1.348 0.548 0 C-N-CA 122.453 2.102 . . . . 0.0 109.973 171.651 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -57.3 -25.1 58.76 Favored 'General case' 0 N--CA 1.474 0.761 0 O-C-N 121.311 -0.868 . . . . 0.0 113.273 -179.364 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 8.7 p-10 -70.24 -9.51 56.1 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.33 1.452 . . . . 0.0 114.464 176.726 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 18.6 m-85 -80.22 -12.64 59.61 Favored 'General case' 0 CA--C 1.539 0.539 0 N-CA-C 116.668 2.099 . . . . 0.0 116.668 164.949 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 589' ' ' THR . . . . . 0.545 HG22 ' HA ' ' A' ' 527' ' ' ALA . 39.4 p -127.26 176.87 7.08 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 125.543 1.537 . . . . 0.0 110.591 -170.727 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 16.7 pt-20 -134.67 147.98 50.25 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 124.96 1.304 . . . . 0.0 110.747 173.085 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 2.7 tmm_? -60.21 136.85 58.15 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 124.631 1.173 . . . . 0.0 112.812 173.054 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 592' ' ' VAL . . . . . 0.476 HG23 ' CB ' ' A' ' 524' ' ' LYS . 1.1 m -139.76 154.84 71.33 Favored Pre-proline 0 CA--C 1.549 0.909 0 C-N-CA 126.752 2.021 . . . . 0.0 109.302 177.099 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 593' ' ' PRO . . . . . . . . . . . . . 81.6 Cg_endo . . . . . 0 C--O 1.251 1.158 1 C-N-CA 125.433 4.089 . . . . 0.0 113.788 -178.652 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B 1728 ' ' SER . . . . . . . . . . . . . 44.8 t . . . . . 0 N--CA 1.475 0.823 0 CA-C-O 120.548 0.213 . . . . 0.0 110.772 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B 1729 ' ' THR . . . . . . . . . . . . 0.43 0.7 OUTLIER 69.97 9.35 7.07 Favored 'General case' 0 N--CA 1.482 1.129 0 N-CA-C 118.139 2.644 . . . . 0.0 118.139 173.283 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B 1730 ' ' VAL . . . . . . . . . . . . . 28.8 m -65.8 149.4 97.51 Favored Pre-proline 0 N--CA 1.478 0.935 0 C-N-CA 125.168 1.387 . . . . 0.0 112.39 179.371 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -65.66 174.98 4.79 Favored 'Trans proline' 0 CA--C 1.544 0.988 0 C-N-CA 124.541 3.494 . . . . 0.0 114.065 178.921 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 7.7 p -139.82 136.27 38.98 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 C-N-CA 125.3 1.44 . . . . 0.0 111.815 179.634 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -70.24 141.76 89.09 Favored Pre-proline 0 CA--C 1.553 1.081 0 O-C-N 121.496 -0.752 . . . . 0.0 112.915 -176.276 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -74.37 163.88 35.3 Favored 'Trans proline' 0 CA--C 1.543 0.93 0 C-N-CA 122.804 2.336 . . . . 0.0 111.947 174.329 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -65.57 148.43 87.4 Favored 'Trans proline' 0 CA--C 1.541 0.862 0 C-N-CA 122.581 2.187 . . . . 0.0 112.116 179.396 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B 1736 ' ' ARG . . . . . . . . . . . . . 31.4 mtp-105 -107.15 144.92 33.18 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 124.809 1.244 . . . . 0.0 112.159 169.828 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B 1737 ' ' ARG . . . . . . . . . . . . . 9.3 mmt85 -103.64 159.69 15.39 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 124.926 1.29 . . . . 0.0 113.761 -151.66 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B 1738 ' ' ARG . . . . . . . . . . . . . 31.3 tpt85 -63.08 -39.42 94.66 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 125.19 1.396 . . . . 0.0 113.17 -175.539 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B 1739 ' ' ARG . . . . . . . . . . . . . 9.5 mtt85 -170.65 101.21 0.24 Allowed 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 128.851 2.86 . . . . 0.0 109.293 152.37 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B 1740 ' ' GLY . . . . . . . . . . . . . . . 57.19 -139.57 46.2 Favored Glycine 0 CA--C 1.535 1.297 0 C-N-CA 124.305 0.955 . . . . 0.0 114.325 175.364 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B 1741 ' ' ARG . . . . . . . . . . . . . 14.2 mmm180 -108.52 7.46 26.82 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 124.808 1.243 . . . . 0.0 113.828 177.007 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B 1742 ' ' ASN . . . . . . . . . . . . . 47.9 t30 -77.54 73.85 4.1 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 125.239 1.415 . . . . 0.0 111.498 178.397 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B 1743 ' ' LEU . . . . . . . . . . . . . 51.4 mt -72.75 -20.33 61.21 Favored 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 114.623 1.342 . . . . 0.0 114.623 -170.304 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B 1744 ' ' THR . . . . . . . . . . . . 0.325 0.6 OUTLIER . . . . . 0 C--O 1.251 1.141 0 N-CA-C 117.56 2.429 . . . . 0.0 117.56 -176.487 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 513' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 1.088 0 N-CA-C 111.843 -0.503 . . . . 0.0 111.843 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 514' ' ' ARG . . . . . . . . . . . . . 11.8 mmt180 -69.02 -43.23 75.19 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 125.218 1.407 . . . . 0.0 114.164 -174.694 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 44.0 mt 65.36 -15.75 0.1 Allowed 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 128.78 2.832 . . . . 0.0 115.401 -158.287 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 516' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -77.77 157.36 30.04 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.206 1.402 . . . . 0.0 113.908 174.331 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 517' ' ' LEU . . . . . 0.472 HD22 HD22 ' A' ' 548' ' ' LEU . 18.0 mt -136.21 160.97 64.99 Favored Pre-proline 0 CA--C 1.547 0.832 0 C-N-CA 125.719 1.608 . . . . 0.0 113.731 -160.626 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 34.8 Cg_endo -67.3 161.07 44.72 Favored 'Trans proline' 0 CA--C 1.54 0.805 0 C-N-CA 124.296 3.331 . . . . 0.0 114.298 -173.72 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -63.87 128.26 21.54 Favored 'Trans proline' 0 C--N 1.35 0.616 0 C-N-CA 123.065 2.51 . . . . 0.0 110.414 -178.623 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 75.34 3.9 72.26 Favored Glycine 0 CA--C 1.534 1.221 0 CA-C-O 117.425 -1.764 . . . . 0.0 115.367 -177.246 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 31.7 t80 -36.17 132.19 0.56 Allowed 'General case' 0 CA--C 1.545 0.763 0 N-CA-C 117.387 2.366 . . . . 0.0 117.387 177.168 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 38.0 mtm -100.06 -56.55 2.34 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 123.848 0.859 . . . . 0.0 112.437 -177.195 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 523' ' ' PHE . . . . . . . . . . . . . 28.6 p90 -167.06 168.18 13.93 Favored 'General case' 0 C--O 1.225 -0.229 0 C-N-CA 127.44 2.296 . . . . 0.0 112.245 -172.279 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 524' ' ' LYS . . . . . 0.547 ' HB2' HG23 ' A' ' 592' ' ' VAL . 82.2 mttt -103.1 163.61 12.12 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 121.135 -0.978 . . . . 0.0 111.356 171.331 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 12.0 m -134.26 160.5 41.62 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.813 0 C-N-CA 126.889 2.076 . . . . 0.0 109.331 165.268 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 48.0 tt0 -124.06 128.26 49.07 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-N 119.618 1.099 . . . . 0.0 112.324 170.236 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 527' ' ' ALA . . . . . 0.479 ' HA ' HG22 ' A' ' 589' ' ' THR . . . -60.62 123.91 18.83 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 124.401 1.081 . . . . 0.0 111.105 178.049 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 76.5 mm-40 -85.39 -37.6 19.68 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 125.448 1.499 . . . . 0.0 111.104 171.103 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 81.3 m-70 -127.63 155.59 43.65 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 127.025 2.13 . . . . 0.0 109.438 176.624 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -82.19 151.29 26.96 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 107.41 -1.33 . . . . 0.0 107.41 178.387 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 94.1 t80 -137.88 113.82 9.89 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 125.099 1.36 . . . . 0.0 113.288 -178.609 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 2.0 m -86.36 118.89 26.09 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 124.405 1.082 . . . . 0.0 113.45 172.696 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -70.22 146.58 50.6 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 124.896 1.278 . . . . 0.0 113.077 -179.864 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 14.5 t -102.01 -31.78 10.48 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 125.314 1.446 . . . . 0.0 113.381 171.111 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 87.2 m-20 -108.08 155.32 20.52 Favored 'General case' 0 N--CA 1.47 0.544 0 N-CA-C 116.808 2.151 . . . . 0.0 116.808 -172.389 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 4.3 t -65.91 -13.3 59.43 Favored 'General case' 0 N--CA 1.483 1.198 0 N-CA-C 116.51 2.041 . . . . 0.0 116.51 -178.547 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . 0.298 63.6 m-20 -113.75 2.53 15.21 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 117.114 2.265 . . . . 0.0 117.114 167.6 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 53.0 mt-10 -74.22 142.84 45.34 Favored 'General case' 0 CA--C 1.541 0.619 0 O-C-N 120.253 -1.53 . . . . 0.0 111.412 167.09 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -89.62 130.98 35.84 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 126.133 1.773 . . . . 0.0 109.643 176.21 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 14.7 tt0 -85.19 131.25 34.46 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 121.677 -0.639 . . . . 0.0 111.422 173.054 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 75.0 mt -121.11 151.1 40.26 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 124.423 1.089 . . . . 0.0 112.631 179.004 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 6.8 tmtt? -116.85 140.57 49.29 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 126.322 1.849 . . . . 0.0 109.753 169.496 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -53.9 106.6 0.2 Allowed 'General case' 0 CA--C 1.548 0.875 0 CA-C-N 119.12 0.873 . . . . 0.0 110.968 175.515 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 114.63 -6.84 22.44 Favored Glycine 0 CA--C 1.538 1.48 0 C-N-CA 125.518 1.533 . . . . 0.0 114.743 -172.943 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -65.5 118.97 10.22 Favored 'General case' 0 CA--C 1.519 -0.227 0 CA-C-N 119.503 1.651 . . . . 0.0 113.723 174.613 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 2.8 t -70.63 134.52 29.9 Favored 'Isoleucine or valine' 0 C--O 1.236 0.352 0 C-N-CA 120.656 -0.418 . . . . 0.0 110.252 159.208 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 1.1 t -123.32 124.47 69.94 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 C-N-CA 125.612 1.565 . . . . 0.0 110.93 175.388 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 548' ' ' LEU . . . . . 0.472 HD22 HD22 ' A' ' 517' ' ' LEU . 22.2 mt -83.75 99.15 10.08 Favored 'General case' 0 C--N 1.324 -0.541 0 C-N-CA 124.56 1.144 . . . . 0.0 108.216 179.293 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 549' ' ' VAL . . . . . . . . . . . . . 4.1 t -61.57 129.56 24.66 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.109 0 N-CA-C 114.052 1.131 . . . . 0.0 114.052 174.545 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 10.5 pt -124.18 153.73 68.38 Favored Pre-proline 0 CA--C 1.548 0.874 0 C-N-CA 126.44 1.896 . . . . 0.0 110.723 178.233 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -71.17 135.46 27.17 Favored 'Trans proline' 0 CA--C 1.534 0.508 0 C-N-CA 123.91 3.074 . . . . 0.0 111.296 178.56 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 552' ' ' PHE . . . . . 0.443 ' CE1' ' HA ' ' A' ' 558' ' ' GLN . 23.9 m-85 -59.64 138.14 57.82 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 117.664 2.468 . . . . 0.0 117.664 -174.963 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 553' ' ' GLN . . . . . . . . . . . . . 23.6 pt20 -69.67 -24.09 63.56 Favored 'General case' 0 CA--C 1.544 0.726 0 N-CA-C 114.411 1.263 . . . . 0.0 114.411 179.092 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 31.9 m-20 -145.23 149.31 41.09 Favored Pre-proline 0 CA--C 1.543 0.69 0 C-N-CA 125.962 1.705 . . . . 0.0 111.893 178.626 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 555' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_endo -67.85 -39.31 11.57 Favored 'Trans proline' 0 CA--C 1.539 0.753 0 C-N-CA 123.64 2.893 . . . . 0.0 112.68 179.003 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 22.5 pt-20 -70.32 -19.61 63.06 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 124.61 1.164 . . . . 0.0 113.817 176.717 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 557' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -78.32 -21.84 49.01 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 113.462 0.912 . . . . 0.0 113.462 177.098 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 558' ' ' GLN . . . . . 0.443 ' HA ' ' CE1' ' A' ' 552' ' ' PHE . 40.0 tp60 -64.72 146.6 54.54 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 122.154 0.978 . . . . 0.0 111.853 165.534 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . 0.256 6.6 m-20 -141.16 150.66 43.05 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 126.485 1.914 . . . . 0.0 114.525 174.661 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 51.3 tp10 -75.23 127.5 33.33 Favored 'General case' 0 N--CA 1.472 0.64 0 O-C-N 121.013 -1.054 . . . . 0.0 111.06 -173.492 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 82.18 -7.26 64.33 Favored Glycine 0 CA--C 1.538 1.518 0 C-N-CA 124.484 1.04 . . . . 0.0 114.255 -168.874 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 60.8 m95 -98.41 155.57 17.17 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.851 1.261 . . . . 0.0 112.897 178.927 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 6.8 mt -143.55 152.49 41.5 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 125.201 1.401 . . . . 0.0 110.493 176.475 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 55.7 ttm -110.45 140.28 44.85 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 124.275 1.03 . . . . 0.0 112.359 -179.587 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -172.69 -171.69 37.71 Favored Glycine 0 CA--C 1.524 0.641 0 C-N-CA 123.92 0.772 . . . . 0.0 113.237 -179.284 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 11.6 p -131.87 143.2 40.94 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.53 0 C-N-CA 125.131 1.372 . . . . 0.0 110.506 172.375 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 42.0 mtmt -57.94 131.49 50.58 Favored 'General case' 0 N--CA 1.467 0.397 0 O-C-N 121.615 -0.678 . . . . 0.0 111.704 175.08 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -62.49 -40.59 97.19 Favored 'General case' 0 C--O 1.223 -0.325 0 CA-C-O 118.281 -0.866 . . . . 0.0 110.548 176.543 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 26.6 t -58.74 -32.33 69.13 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 119.559 1.072 . . . . 0.0 112.291 177.003 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -76.77 -45.72 27.94 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 114.98 1.474 . . . . 0.0 114.98 177.038 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 56.2 t-105 -67.28 -39.15 85.97 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.85 1.26 . . . . 0.0 112.957 176.492 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 5.0 t-20 -64.17 -28.71 69.94 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 124.894 1.278 . . . . 0.0 111.201 176.061 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 39.4 mt-30 -92.0 7.17 43.42 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.429 1.492 . . . . 0.0 114.614 171.991 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 89.0 m-70 56.48 34.74 24.83 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 126.432 1.893 . . . . 0.0 114.449 176.508 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 62.2 mttt -73.78 155.77 38.51 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.452 1.101 . . . . 0.0 111.614 174.553 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 12.8 pm0 -57.03 102.93 0.09 Allowed 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 115.403 1.631 . . . . 0.0 115.403 -170.413 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 47.5 tp -53.0 -45.91 68.09 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 125.097 1.359 . . . . 0.0 112.165 -176.697 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 19.5 pt-20 -63.21 -16.14 59.24 Favored 'General case' 0 N--CA 1.479 0.999 0 N-CA-C 115.202 1.556 . . . . 0.0 115.202 -176.889 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 29.0 tptp -114.57 -37.0 4.4 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 125.927 1.691 . . . . 0.0 112.345 -178.987 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 47.9 t -70.23 -30.57 67.67 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.217 1.407 . . . . 0.0 112.885 176.965 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 30.9 ptt85 -60.58 158.64 12.0 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 124.174 0.989 . . . . 0.0 112.839 176.701 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -179.25 175.91 47.47 Favored Glycine 0 N--CA 1.461 0.337 0 CA-C-N 115.966 -0.561 . . . . 0.0 114.375 173.111 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 34.7 m -88.52 140.19 16.19 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 C-N-CA 124.317 1.047 . . . . 0.0 111.149 167.719 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 43.3 p90 -134.44 155.25 79.88 Favored Pre-proline 0 CA--C 1.538 0.503 0 C-N-CA 125.159 1.383 . . . . 0.0 112.565 173.552 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -66.31 113.58 2.72 Favored 'Trans proline' 0 CA--C 1.536 0.617 0 C-N-CA 122.427 2.085 . . . . 0.0 110.451 171.307 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 15.6 pt-20 -60.28 -26.09 66.22 Favored 'General case' 0 N--CA 1.475 0.786 0 O-C-N 121.108 -0.995 . . . . 0.0 112.03 -178.01 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 13.8 p-10 -71.37 -9.21 57.78 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 126.99 2.116 . . . . 0.0 114.444 177.005 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 14.0 m-85 -81.16 -14.09 57.98 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 116.714 2.116 . . . . 0.0 116.714 163.446 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 589' ' ' THR . . . . . 0.479 HG22 ' HA ' ' A' ' 527' ' ' ALA . 54.7 p -126.61 168.85 13.75 Favored 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 125.106 1.362 . . . . 0.0 110.453 -172.766 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -120.66 141.65 50.18 Favored 'General case' 0 N--CA 1.465 0.289 0 C-N-CA 123.489 0.716 . . . . 0.0 109.857 173.912 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.06 130.13 42.24 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 124.412 1.085 . . . . 0.0 109.157 174.732 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 592' ' ' VAL . . . . . 0.547 HG23 ' HB2' ' A' ' 524' ' ' LYS . 4.7 m -121.6 159.2 51.63 Favored Pre-proline 0 N--CA 1.477 0.92 0 C-N-CA 125.186 1.394 . . . . 0.0 108.938 179.446 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 593' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo . . . . . 0 C--O 1.252 1.202 0 C-N-CA 123.968 3.112 . . . . 0.0 114.66 -174.468 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B 1728 ' ' SER . . . . . . . . . . . . . 95.5 p . . . . . 0 N--CA 1.47 0.569 0 CA-C-O 120.444 0.164 . . . . 0.0 110.982 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B 1729 ' ' THR . . . . . . . . . . . . 0.42 1.1 p 63.41 12.43 6.31 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 117.324 2.342 . . . . 0.0 117.324 174.032 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B 1730 ' ' VAL . . . . . . . . . . . . . 3.1 m -73.76 142.81 80.75 Favored Pre-proline 0 N--CA 1.474 0.748 0 C-N-CA 123.494 0.718 . . . . 0.0 112.864 178.709 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 92.9 Cg_endo -75.45 162.92 35.26 Favored 'Trans proline' 0 CA--C 1.54 0.805 0 C-N-CA 122.986 2.458 . . . . 0.0 112.186 172.648 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 51.8 t -137.17 134.0 47.35 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 C-N-CA 125.461 1.504 . . . . 0.0 110.313 177.479 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -68.14 133.0 91.7 Favored Pre-proline 0 CA--C 1.547 0.849 0 CA-C-O 118.237 -0.887 . . . . 0.0 111.608 -175.23 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 3.2 Cg_exo -65.07 166.49 18.56 Favored 'Trans proline' 0 CA--C 1.541 0.839 0 C-N-CA 122.69 2.26 . . . . 0.0 113.221 -178.611 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 36.9 Cg_exo -60.26 160.66 22.32 Favored 'Trans proline' 0 CA--C 1.54 0.778 0 C-N-CA 122.998 2.465 . . . . 0.0 112.364 162.688 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B 1736 ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -131.81 173.83 10.76 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 124.694 1.198 . . . . 0.0 112.116 175.639 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B 1737 ' ' ARG . . . . . . . . . . . . . 51.5 mtt180 -135.4 97.72 3.77 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 126.918 2.087 . . . . 0.0 107.838 177.13 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B 1738 ' ' ARG . . . . . . . . . . . . . 46.5 mtt85 -68.47 160.2 30.21 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-O 121.455 0.645 . . . . 0.0 111.362 -179.841 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B 1739 ' ' ARG . . . . . . . . . . . . . 46.6 ptt85 -84.24 50.05 1.78 Allowed 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 124.845 1.258 . . . . 0.0 112.258 171.421 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B 1740 ' ' GLY . . . . . . . . . . . . . . . 67.06 178.69 10.57 Favored Glycine 0 CA--C 1.538 1.51 0 N-CA-C 111.527 -0.629 . . . . 0.0 111.527 -151.766 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B 1741 ' ' ARG . . . . . . . . . . . . . 77.5 mtm180 -75.39 54.91 0.76 Allowed 'General case' 0 N--CA 1.481 1.092 0 O-C-N 120.869 -1.371 . . . . 0.0 112.335 173.577 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B 1742 ' ' ASN . . . . . . . . . . . . . 70.7 m-80 -117.21 10.44 13.8 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 126.416 1.887 . . . . 0.0 113.358 -172.196 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B 1743 ' ' LEU . . . . . . . . . . . . . 8.0 mp -61.07 148.11 41.51 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 123.815 0.846 . . . . 0.0 109.382 176.57 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B 1744 ' ' THR . . . . . . . . . . . . 0.356 0.2 OUTLIER . . . . . 0 C--O 1.248 1.008 0 N-CA-C 118.032 2.605 . . . . 0.0 118.032 -167.345 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 513' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 1.0 0 N-CA-C 110.854 -0.898 . . . . 0.0 110.854 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 514' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.57 -25.22 0.47 Allowed 'General case' 0 N--CA 1.476 0.837 0 N-CA-C 117.31 2.337 . . . . 0.0 117.31 -169.871 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 9.0 tt 57.71 -45.43 0.05 OUTLIER 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 128.148 2.579 . . . . 0.0 115.865 -166.619 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 516' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -42.71 147.09 0.32 Allowed 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 129.918 3.287 . . . . 0.0 118.394 178.406 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 517' ' ' LEU . . . . . 0.447 HD22 HD22 ' A' ' 548' ' ' LEU . 12.8 mt -131.9 158.28 75.9 Favored Pre-proline 0 CA--C 1.544 0.732 0 C-N-CA 125.567 1.547 . . . . 0.0 113.32 -169.456 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_endo -67.71 160.82 46.49 Favored 'Trans proline' 0 CA--C 1.543 0.97 0 C-N-CA 124.304 3.336 . . . . 0.0 114.622 -172.875 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 66.2 Cg_endo -64.07 133.53 38.77 Favored 'Trans proline' 0 C--N 1.349 0.558 0 C-N-CA 123.267 2.645 . . . . 0.0 110.488 177.56 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 73.8 0.61 55.99 Favored Glycine 0 CA--C 1.535 1.292 0 CA-C-O 117.36 -1.8 . . . . 0.0 115.386 -175.785 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 38.7 t80 -36.59 123.31 0.81 Allowed 'General case' 0 C--N 1.349 0.582 0 CA-C-N 120.717 2.258 . . . . 0.0 116.634 179.823 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 50.1 mtm -94.98 -54.2 3.54 Favored 'General case' 0 N--CA 1.465 0.316 0 C-N-CA 123.252 0.621 . . . . 0.0 111.28 -177.206 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 523' ' ' PHE . . . . . . . . . . . . . 24.9 p90 -167.96 167.16 12.93 Favored 'General case' 0 C--O 1.223 -0.314 0 C-N-CA 126.646 1.978 . . . . 0.0 113.085 -172.685 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 524' ' ' LYS . . . . . 0.583 ' HB2' HG23 ' A' ' 592' ' ' VAL . 80.6 mttt -100.26 161.74 13.41 Favored 'General case' 0 C--N 1.326 -0.433 0 O-C-N 121.3 -0.875 . . . . 0.0 111.039 167.616 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 18.0 m -136.86 154.88 32.27 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 C-N-CA 126.742 2.017 . . . . 0.0 108.794 167.833 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 44.6 tt0 -118.68 129.13 55.12 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 119.698 1.135 . . . . 0.0 111.261 173.063 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 527' ' ' ALA . . . . . 0.504 ' HA ' HG22 ' A' ' 589' ' ' THR . . . -62.72 119.32 9.06 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 124.028 0.931 . . . . 0.0 112.181 -178.444 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 44.7 mm-40 -85.79 -15.31 42.44 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 125.734 1.614 . . . . 0.0 111.932 173.958 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 92.3 m-70 -147.75 156.87 43.2 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 126.067 1.747 . . . . 0.0 111.369 -172.512 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -81.91 124.22 29.54 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 125.416 1.486 . . . . 0.0 114.646 175.957 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 88.4 t80 -129.87 114.56 16.04 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 124.68 1.192 . . . . 0.0 112.333 -177.426 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -83.04 125.63 31.67 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 124.341 1.056 . . . . 0.0 113.425 171.856 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -64.39 137.58 57.97 Favored 'General case' 0 CA--C 1.537 0.474 0 O-C-N 121.293 -0.879 . . . . 0.0 110.48 175.708 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 534' ' ' THR . . . . . . . . . . . . 0.272 2.0 t -132.35 3.53 3.94 Favored 'General case' 0 N--CA 1.473 0.722 0 N-CA-C 115.501 1.667 . . . . 0.0 115.501 -173.211 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -136.09 159.43 41.75 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 126.834 2.054 . . . . 0.0 115.1 165.509 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 1.2 t -61.76 -12.18 15.76 Favored 'General case' 0 N--CA 1.476 0.833 0 N-CA-C 117.143 2.275 . . . . 0.0 117.143 -172.563 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 17.5 p30 -111.91 -0.79 15.69 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 127.716 2.406 . . . . 0.0 116.366 177.866 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 76.7 mt-10 -81.47 144.11 31.59 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 114.437 1.273 . . . . 0.0 114.437 -175.634 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -84.86 152.23 23.73 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 125.825 1.65 . . . . 0.0 109.945 171.133 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -119.3 128.21 53.93 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 125.101 1.36 . . . . 0.0 110.541 -176.734 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 74.4 mt -128.07 146.72 50.6 Favored 'General case' 0 N--CA 1.471 0.575 0 C-N-CA 124.761 1.224 . . . . 0.0 112.25 -168.935 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -120.35 143.46 48.38 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 126.86 2.064 . . . . 0.0 109.404 173.232 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -55.77 99.69 0.03 OUTLIER 'General case' 0 CA--C 1.552 1.021 0 CA-C-N 119.619 1.099 . . . . 0.0 112.533 178.889 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 125.99 -7.22 7.73 Favored Glycine 0 CA--C 1.537 1.461 0 C-N-CA 126.545 2.021 . . . . 0.0 115.174 -173.728 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 80.4 m-20 -73.04 121.75 20.65 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-N 120.18 1.99 . . . . 0.0 114.223 -177.609 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 4.1 t -73.36 133.99 30.6 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 CA-C-N 119.386 0.994 . . . . 0.0 111.373 165.306 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 1.4 t -119.74 124.63 73.19 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.516 0 C-N-CA 126.173 1.789 . . . . 0.0 111.048 172.492 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 548' ' ' LEU . . . . . 0.451 ' CD2' ' HE2' ' A' ' 524' ' ' LYS . 22.5 mt -80.28 98.63 7.49 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 174.637 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 549' ' ' VAL . . . . . . . . . . . . . 4.1 t -62.95 130.4 27.52 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 N-CA-C 114.449 1.277 . . . . 0.0 114.449 174.283 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 20.9 pt -127.3 157.65 71.9 Favored Pre-proline 0 CA--C 1.546 0.805 0 C-N-CA 127.034 2.134 . . . . 0.0 109.838 177.73 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo -71.05 154.27 62.64 Favored 'Trans proline' 0 CA--C 1.54 0.789 0 C-N-CA 123.358 2.705 . . . . 0.0 112.431 174.565 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 43.5 m-85 -67.1 155.79 37.82 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 116.855 2.168 . . . . 0.0 116.855 177.994 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 553' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -65.96 -21.01 66.39 Favored 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 114.653 1.353 . . . . 0.0 114.653 -178.666 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 4.0 t30 -160.94 151.2 14.73 Favored Pre-proline 0 CA--C 1.545 0.787 0 C-N-CA 126.114 1.766 . . . . 0.0 107.963 178.338 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 555' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -68.47 -30.93 28.56 Favored 'Trans proline' 0 CA--C 1.536 0.611 0 C-N-CA 123.839 3.026 . . . . 0.0 112.567 -175.741 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 17.6 pt-20 -90.55 -11.63 39.53 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 114.347 1.239 . . . . 0.0 114.347 -179.632 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 557' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.94 -26.94 43.58 Favored 'General case' 0 CA--C 1.543 0.679 0 O-C-N 121.631 -0.668 . . . . 0.0 111.831 171.719 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 40.6 tt0 -60.81 120.52 10.28 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 126.048 1.739 . . . . 0.0 113.995 -177.607 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -85.49 131.28 34.4 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.175 1.39 . . . . 0.0 109.158 -177.867 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 73.6 tt0 -60.66 130.74 48.01 Favored 'General case' 0 N--CA 1.472 0.654 0 O-C-N 121.014 -1.054 . . . . 0.0 111.68 178.023 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 84.89 -12.02 58.45 Favored Glycine 0 CA--C 1.532 1.148 0 C-N-CA 124.833 1.206 . . . . 0.0 114.966 -178.7 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 48.6 m95 -91.48 155.48 18.39 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 124.664 1.186 . . . . 0.0 113.048 178.98 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 14.1 mt -126.76 151.94 47.54 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 124.038 0.935 . . . . 0.0 110.455 170.345 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 56.5 ttm -109.84 143.4 39.78 Favored 'General case' 0 N--CA 1.464 0.243 0 C-N-CA 124.179 0.992 . . . . 0.0 111.003 174.842 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -170.9 -172.9 37.61 Favored Glycine 0 CA--C 1.524 0.597 0 C-N-CA 123.888 0.756 . . . . 0.0 112.765 177.898 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 14.1 p -133.63 139.61 48.44 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.487 0 C-N-CA 125.232 1.413 . . . . 0.0 108.79 170.972 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 36.4 mtmt -58.49 136.68 57.58 Favored 'General case' 0 N--CA 1.467 0.418 0 O-C-N 121.215 -0.928 . . . . 0.0 111.16 175.71 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 19.6 tt0 -61.73 -40.74 96.17 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 118.281 -0.866 . . . . 0.0 110.876 179.436 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 34.3 m -61.38 -35.62 77.99 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 119.456 1.025 . . . . 0.0 112.663 176.48 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 67.1 m-20 -68.34 -46.62 69.66 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 125.742 1.617 . . . . 0.0 115.067 174.351 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 53.4 t-105 -66.94 -33.63 76.0 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 124.315 1.046 . . . . 0.0 112.242 174.532 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 4.2 t-20 -73.35 -23.7 60.25 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.273 1.429 . . . . 0.0 112.672 172.097 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 38.3 mt-30 -77.17 0.25 22.46 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 125.046 1.338 . . . . 0.0 113.399 168.279 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 91.9 m-70 62.18 31.71 17.55 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.442 1.497 . . . . 0.0 113.483 172.94 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 79.1 mttt -76.72 157.58 31.61 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 126.046 1.738 . . . . 0.0 112.083 177.176 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -62.23 113.47 2.9 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 124.348 1.059 . . . . 0.0 113.145 174.426 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 59.6 tp -56.32 -42.74 78.14 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.465 1.506 . . . . 0.0 112.046 -178.814 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 23.9 pt-20 -68.95 -8.36 43.79 Favored 'General case' 0 N--CA 1.477 0.88 0 N-CA-C 115.06 1.504 . . . . 0.0 115.06 -173.778 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 34.8 mmtp -111.72 -41.35 4.07 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 124.72 1.208 . . . . 0.0 111.778 166.78 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 96.6 m -76.49 -17.47 59.27 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 115.059 1.503 . . . . 0.0 115.059 -172.18 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 20.4 ptt180 -65.13 163.85 14.22 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 125.011 1.324 . . . . 0.0 112.629 169.279 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -167.11 174.18 42.36 Favored Glycine 0 CA--C 1.526 0.754 0 CA-C-N 114.734 -1.121 . . . . 0.0 113.985 169.542 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 31.5 m -93.55 140.83 15.74 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.594 0 C-N-CA 124.748 1.219 . . . . 0.0 110.705 168.333 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 40.9 p90 -138.02 156.54 74.03 Favored Pre-proline 0 CA--C 1.543 0.684 0 C-N-CA 124.274 1.03 . . . . 0.0 113.245 177.291 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -66.97 111.89 2.33 Favored 'Trans proline' 0 CA--C 1.535 0.571 0 C-N-CA 122.629 2.219 . . . . 0.0 110.169 170.015 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 22.1 pt-20 -56.22 -29.83 61.51 Favored 'General case' 0 N--CA 1.475 0.821 0 O-C-N 121.309 -0.87 . . . . 0.0 112.5 -178.72 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 13.0 p-10 -69.2 -14.14 62.8 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 127.019 2.127 . . . . 0.0 113.867 -179.587 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 18.8 m-85 -75.21 -8.86 57.78 Favored 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 116.952 2.205 . . . . 0.0 116.952 164.64 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 589' ' ' THR . . . . . 0.504 HG22 ' HA ' ' A' ' 527' ' ' ALA . 70.0 p -130.3 168.48 16.82 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 125.39 1.476 . . . . 0.0 111.827 -173.387 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -124.52 137.86 54.38 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 123.93 0.892 . . . . 0.0 109.791 173.422 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.93 137.85 56.36 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 124.712 1.205 . . . . 0.0 110.549 174.871 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 592' ' ' VAL . . . . . 0.583 HG23 ' HB2' ' A' ' 524' ' ' LYS . 2.7 m -130.18 162.52 53.62 Favored Pre-proline 0 N--CA 1.48 1.029 0 C-N-CA 125.623 1.569 . . . . 0.0 109.601 178.322 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 593' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo . . . . . 0 C--O 1.255 1.338 0 C-N-CA 124.626 3.551 . . . . 0.0 115.067 -178.714 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B 1728 ' ' SER . . . . . . . . . . . . . 58.5 p . . . . . 0 N--CA 1.474 0.75 0 CA-C-O 118.626 -0.702 . . . . 0.0 112.213 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B 1729 ' ' THR . . . . . . . . . . . . 0.276 1.3 p -123.88 -17.4 6.32 Favored 'General case' 0 N--CA 1.481 1.125 0 N-CA-C 117.293 2.331 . . . . 0.0 117.293 -176.78 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B 1730 ' ' VAL . . . . . . . . . . . . . 2.5 m -94.67 148.19 34.45 Favored Pre-proline 0 N--CA 1.479 1.008 0 N-CA-C 114.138 1.162 . . . . 0.0 114.138 179.085 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -77.98 169.79 19.91 Favored 'Trans proline' 0 CA--C 1.541 0.847 0 C-N-CA 124.366 3.377 . . . . 0.0 113.535 174.57 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 90.6 t -131.93 136.8 56.18 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.854 0 C-N-CA 126.559 1.944 . . . . 0.0 108.431 173.629 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -62.34 139.04 96.41 Favored Pre-proline 0 CA--C 1.547 0.864 0 O-C-N 121.78 -0.575 . . . . 0.0 111.952 -177.344 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -69.04 161.36 46.15 Favored 'Trans proline' 0 CA--C 1.539 0.738 0 C-N-CA 121.976 1.784 . . . . 0.0 110.587 177.995 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 46.9 Cg_exo -55.78 153.68 29.53 Favored 'Trans proline' 0 N--CA 1.459 -0.51 0 C-N-CA 122.227 1.952 . . . . 0.0 111.95 176.194 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B 1736 ' ' ARG . . . . . . . . . . . . . 80.1 mtp180 -104.96 146.0 29.64 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 123.817 0.847 . . . . 0.0 110.505 164.456 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B 1737 ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -165.55 176.62 8.0 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 125.281 1.432 . . . . 0.0 113.065 -152.196 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B 1738 ' ' ARG . . . . . . . . . . . . . 62.2 ttt180 69.58 -38.79 0.41 Allowed 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 128.97 2.908 . . . . 0.0 117.475 170.546 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B 1739 ' ' ARG . . . . . . . . . . . . . 81.5 mtm180 -64.68 132.8 50.69 Favored 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 115.42 1.637 . . . . 0.0 115.42 -162.205 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B 1740 ' ' GLY . . . . . . . . . . . . . . . 83.85 -158.95 35.65 Favored Glycine 0 CA--C 1.532 1.105 0 N-CA-C 114.895 0.718 . . . . 0.0 114.895 165.401 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B 1741 ' ' ARG . . . . . . . . . . . . . 24.2 ttm105 56.28 55.7 6.44 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 125.97 1.708 . . . . 0.0 112.637 -175.471 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B 1742 ' ' ASN . . . . . . . . . . . . . 51.5 t30 -74.62 -32.5 62.34 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.475 1.11 . . . . 0.0 112.096 175.96 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B 1743 ' ' LEU . . . . . . . . . . . . . 4.2 mm? -104.88 160.83 14.7 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.975 1.31 . . . . 0.0 111.487 178.685 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B 1744 ' ' THR . . . . . . . . . . . . 0.289 5.8 p . . . . . 0 C--O 1.255 1.345 0 C-N-CA 125.172 1.389 . . . . 0.0 113.714 169.789 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 513' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.946 0 N-CA-C 111.103 -0.799 . . . . 0.0 111.103 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 514' ' ' ARG . . . . . . . . . . . . . 12.6 ptm180 -144.25 169.62 17.55 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 125.657 1.583 . . . . 0.0 110.074 177.913 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -120.34 -35.48 3.42 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 124.737 1.215 . . . . 0.0 111.311 -179.458 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 516' ' ' ASP . . . . . . . . . . . . . 48.2 t0 -67.23 140.91 57.42 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 125.401 1.48 . . . . 0.0 111.737 -179.928 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 517' ' ' LEU . . . . . 0.469 HD22 HD22 ' A' ' 548' ' ' LEU . 13.2 mt -116.9 162.12 28.99 Favored Pre-proline 0 CA--C 1.543 0.676 0 C-N-CA 127.305 2.242 . . . . 0.0 111.404 -172.369 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_endo -66.99 162.33 38.57 Favored 'Trans proline' 0 CA--C 1.538 0.718 0 C-N-CA 123.436 2.757 . . . . 0.0 114.776 -171.245 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -56.78 128.58 30.55 Favored 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 123.793 2.996 . . . . 0.0 111.077 176.536 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 73.9 2.26 61.04 Favored Glycine 0 CA--C 1.535 1.311 0 CA-C-O 116.956 -2.024 . . . . 0.0 116.384 -176.851 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 35.7 t80 -38.48 127.54 1.44 Allowed 'General case' 0 C--N 1.349 0.563 0 CA-C-N 121.053 2.427 . . . . 0.0 116.909 -175.741 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 48.8 mtm -104.25 -53.17 2.78 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 123.631 0.772 . . . . 0.0 112.116 -176.911 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 523' ' ' PHE . . . . . . . . . . . . . 25.6 p90 -166.58 172.29 10.86 Favored 'General case' 0 N--CA 1.465 0.322 0 C-N-CA 125.775 1.63 . . . . 0.0 113.181 -174.539 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 524' ' ' LYS . . . . . 0.542 ' HE2' ' CD2' ' A' ' 548' ' ' LEU . 78.3 mttt -104.52 164.8 11.49 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 121.214 -0.929 . . . . 0.0 112.446 170.369 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 14.6 m -133.85 161.92 40.22 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 126.686 1.995 . . . . 0.0 109.383 164.688 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 33.1 tt0 -125.44 130.01 50.98 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-N 118.929 0.786 . . . . 0.0 111.919 168.703 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 527' ' ' ALA . . . . . 0.475 ' HA ' HG22 ' A' ' 589' ' ' THR . . . -62.28 127.25 30.48 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.098 0.959 . . . . 0.0 111.518 178.613 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 40.1 mm-40 -88.66 -29.05 20.21 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 125.409 1.483 . . . . 0.0 110.813 170.634 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 97.5 m-70 -137.34 157.19 47.15 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 126.13 1.772 . . . . 0.0 111.518 -176.198 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 14.8 p-10 -83.12 131.6 35.13 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 114.908 1.447 . . . . 0.0 114.908 178.085 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 78.0 t80 -133.75 116.5 15.82 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.337 1.055 . . . . 0.0 112.356 -172.335 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 2.3 m -83.77 125.61 32.09 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 114.947 1.462 . . . . 0.0 114.947 176.657 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -71.67 142.49 49.88 Favored 'General case' 0 CA--C 1.538 0.508 0 O-C-N 121.459 -0.775 . . . . 0.0 111.702 172.634 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 2.9 t -138.44 -4.59 1.64 Allowed 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 126.476 1.91 . . . . 0.0 115.78 -175.845 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 19.6 m-20 -119.53 155.04 32.92 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 127.138 2.175 . . . . 0.0 116.018 164.082 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 5.6 t -55.75 -22.63 25.05 Favored 'General case' 0 N--CA 1.477 0.911 0 N-CA-C 116.62 2.081 . . . . 0.0 116.62 -179.628 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 70.1 m-20 -99.05 -8.14 25.75 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 115.622 1.712 . . . . 0.0 115.622 177.337 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 11.8 mt-10 -74.52 157.07 36.14 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 114.89 1.441 . . . . 0.0 114.89 -177.967 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -103.7 137.37 41.83 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 127.807 2.443 . . . . 0.0 111.147 173.808 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 33.4 tt0 -94.12 121.73 35.92 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.955 1.302 . . . . 0.0 111.512 176.443 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 71.2 mt -118.52 148.18 42.89 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.645 1.178 . . . . 0.0 113.076 -177.429 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 5.9 tppt? -112.25 145.04 40.65 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 127.245 2.218 . . . . 0.0 110.296 166.294 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -56.46 104.04 0.13 Allowed 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.694 0.798 . . . . 0.0 110.565 172.237 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 121.18 -9.45 10.24 Favored Glycine 0 CA--C 1.535 1.305 0 C-N-CA 125.925 1.726 . . . . 0.0 114.736 -173.183 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 88.7 m-20 -70.56 124.9 25.35 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 119.854 1.827 . . . . 0.0 114.945 -178.973 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 2.4 t -74.65 136.54 24.95 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 CA-C-N 118.313 0.506 . . . . 0.0 111.615 165.333 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 1.2 t -128.55 121.4 55.03 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 C-N-CA 124.69 1.196 . . . . 0.0 111.703 176.523 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 548' ' ' LEU . . . . . 0.542 ' CD2' ' HE2' ' A' ' 524' ' ' LYS . 17.2 mt -77.83 100.54 6.36 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.697 1.199 . . . . 0.0 108.533 175.792 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 549' ' ' VAL . . . . . . . . . . . . . 7.2 t -61.42 130.24 25.3 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.966 0 N-CA-C 113.945 1.091 . . . . 0.0 113.945 173.118 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 8.3 pt -127.61 156.76 74.91 Favored Pre-proline 0 CA--C 1.542 0.659 0 C-N-CA 126.443 1.897 . . . . 0.0 109.564 178.102 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 80.0 Cg_endo -70.78 154.19 63.85 Favored 'Trans proline' 0 CA--C 1.538 0.715 0 C-N-CA 123.016 2.477 . . . . 0.0 111.523 171.083 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 33.1 m-85 -65.32 156.96 30.42 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 115.581 1.697 . . . . 0.0 115.581 172.02 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 553' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -65.38 -25.93 67.79 Favored 'General case' 0 CA--C 1.546 0.798 0 N-CA-C 113.115 0.783 . . . . 0.0 113.115 169.956 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 20.6 m-80 -146.92 148.27 32.18 Favored Pre-proline 0 CA--C 1.544 0.738 0 C-N-CA 125.963 1.705 . . . . 0.0 112.516 175.347 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 555' ' ' PRO . . . . . . . . . . . . . 92.9 Cg_endo -70.77 -30.12 18.05 Favored 'Trans proline' 0 CA--C 1.539 0.747 0 C-N-CA 123.91 3.073 . . . . 0.0 113.199 178.787 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 -76.85 -25.33 53.02 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 113.578 0.955 . . . . 0.0 113.578 174.711 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 557' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -74.26 -23.12 59.09 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 123.971 0.908 . . . . 0.0 112.954 177.229 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 38.4 tt0 -64.03 136.83 57.64 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 125.7 1.6 . . . . 0.0 113.184 174.166 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -114.85 137.36 52.05 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 126.657 1.983 . . . . 0.0 113.757 -176.848 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 39.8 tp10 -74.39 133.95 42.45 Favored 'General case' 0 N--CA 1.474 0.744 0 O-C-N 120.406 -1.434 . . . . 0.0 112.664 -168.847 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 84.36 -8.1 69.43 Favored Glycine 0 CA--C 1.536 1.359 0 C-N-CA 125.412 1.482 . . . . 0.0 114.264 -173.4 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 60.2 m95 -92.58 161.41 14.6 Favored 'General case' 0 C--O 1.235 0.291 0 C-N-CA 125.389 1.476 . . . . 0.0 112.642 175.547 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 13.9 mt -132.99 152.15 51.99 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 124.815 1.246 . . . . 0.0 109.603 166.267 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 39.4 tpp -106.68 140.23 39.87 Favored 'General case' 0 N--CA 1.465 0.275 0 C-N-CA 124.46 1.104 . . . . 0.0 110.389 171.732 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -165.33 -172.72 33.1 Favored Glycine 0 CA--C 1.523 0.564 0 CA-C-O 122.191 0.884 . . . . 0.0 113.395 174.376 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 12.7 p -130.15 137.92 55.22 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.383 0 C-N-CA 125.386 1.474 . . . . 0.0 108.816 169.433 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 29.4 mtmt -56.82 134.19 54.99 Favored 'General case' 0 N--CA 1.465 0.303 0 O-C-N 121.406 -0.809 . . . . 0.0 110.917 175.49 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -61.41 -38.75 88.22 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-O 118.993 -0.527 . . . . 0.0 111.042 177.686 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 10.8 t -66.07 -35.0 79.36 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 119.439 1.018 . . . . 0.0 112.246 175.5 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 -59.15 -51.11 71.44 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 114.024 1.12 . . . . 0.0 114.024 168.53 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 61.9 t-105 -69.66 -32.54 71.24 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.685 1.594 . . . . 0.0 113.286 -178.817 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 12.3 t-20 -78.95 -18.38 53.86 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 125.315 1.446 . . . . 0.0 112.607 173.949 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 8.8 mm100 -90.08 5.26 47.49 Favored 'General case' 0 CA--C 1.546 0.822 0 CA-C-N 119.333 0.969 . . . . 0.0 113.514 163.509 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 83.8 m-70 61.85 25.81 15.56 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 126.367 1.867 . . . . 0.0 114.623 172.145 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 78.4 mttt -68.24 155.29 40.0 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 125.448 1.499 . . . . 0.0 111.489 177.28 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 6.9 pm0 -64.53 104.78 0.84 Allowed 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 114.295 1.22 . . . . 0.0 114.295 -169.133 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 56.1 tp -51.91 -45.06 64.09 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.348 1.059 . . . . 0.0 113.266 -173.961 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -66.28 -19.73 65.9 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 114.334 1.235 . . . . 0.0 114.334 -174.171 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 14.6 mmmm -100.37 -41.02 7.2 Favored 'General case' 0 N--CA 1.481 1.111 0 CA-C-N 119.104 0.865 . . . . 0.0 112.208 164.465 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 91.0 m -71.59 -23.61 61.76 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 114.979 1.474 . . . . 0.0 114.979 -169.733 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 38.0 ptt180 -62.38 166.03 5.47 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 125.097 1.359 . . . . 0.0 112.293 172.03 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -176.92 169.45 41.84 Favored Glycine 0 CA--C 1.522 0.509 0 N-CA-C 114.888 0.715 . . . . 0.0 114.888 172.583 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 31.6 m -86.06 145.71 7.42 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.213 0 C-N-CA 123.817 0.847 . . . . 0.0 110.872 170.909 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 47.8 p90 -142.96 155.07 62.62 Favored Pre-proline 0 CA--C 1.545 0.752 0 C-N-CA 125.426 1.49 . . . . 0.0 112.186 174.831 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -68.19 113.61 3.13 Favored 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.361 2.04 . . . . 0.0 109.703 171.441 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 20.2 pt-20 -58.6 -26.47 63.7 Favored 'General case' 0 N--CA 1.475 0.805 0 O-C-N 121.269 -0.894 . . . . 0.0 112.497 -177.668 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 9.0 p-10 -68.77 -16.2 63.73 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 126.503 1.921 . . . . 0.0 114.435 176.73 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 19.0 m-85 -72.78 -14.1 61.46 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 116.749 2.129 . . . . 0.0 116.749 162.008 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 589' ' ' THR . . . . . 0.475 HG22 ' HA ' ' A' ' 527' ' ' ALA . 64.1 p -124.27 177.27 5.94 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 126.173 1.789 . . . . 0.0 110.957 -176.261 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 16.8 pt-20 -131.62 138.57 48.85 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.511 0.724 . . . . 0.0 110.368 170.35 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -70.85 111.75 6.51 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 125.465 1.506 . . . . 0.0 109.849 -177.511 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 592' ' ' VAL . . . . . 0.471 HG23 ' HB2' ' A' ' 524' ' ' LYS . 2.6 m -94.19 159.66 33.66 Favored Pre-proline 0 N--CA 1.479 1.014 0 C-N-CA 124.78 1.232 . . . . 0.0 109.428 -178.688 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 593' ' ' PRO . . . . . . . . . . . . . 92.4 Cg_endo . . . . . 0 C--O 1.249 1.068 0 C-N-CA 124.24 3.293 . . . . 0.0 114.326 -176.71 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B 1728 ' ' SER . . . . . . . . . . . . . 21.9 t . . . . . 0 N--CA 1.474 0.768 0 CA-C-O 120.743 0.306 . . . . 0.0 110.87 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B 1729 ' ' THR . . . . . . . . . . . . 0.254 0.9 OUTLIER -130.26 -8.96 4.25 Favored 'General case' 0 N--CA 1.482 1.152 0 N-CA-C 117.023 2.231 . . . . 0.0 117.023 176.894 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B 1730 ' ' VAL . . . . . . . . . . . . . 4.3 m -58.69 155.17 31.62 Favored Pre-proline 0 N--CA 1.479 0.975 0 C-N-CA 125.448 1.499 . . . . 0.0 113.23 -179.933 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 39.0 Cg_endo -60.6 160.33 24.76 Favored 'Trans proline' 0 C--N 1.35 0.613 0 C-N-CA 123.057 2.505 . . . . 0.0 113.651 -177.467 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 19.9 t -132.64 125.36 52.85 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 125.337 1.455 . . . . 0.0 111.445 -178.324 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -66.04 141.11 97.33 Favored Pre-proline 0 CA--C 1.547 0.853 0 C-N-CA 123.639 0.776 . . . . 0.0 113.035 -174.443 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -72.7 167.17 27.88 Favored 'Trans proline' 0 CA--C 1.547 1.149 0 C-N-CA 122.415 2.076 . . . . 0.0 112.579 175.557 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -60.04 153.98 54.28 Favored 'Trans proline' 0 CA--C 1.536 0.608 0 C-N-CA 123.097 2.531 . . . . 0.0 113.244 174.495 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B 1736 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.45 154.2 42.36 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 124.743 1.217 . . . . 0.0 110.714 174.2 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B 1737 ' ' ARG . . . . . . . . . . . . . 32.1 mmt180 -130.84 129.73 42.72 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 125.665 1.586 . . . . 0.0 110.188 -169.694 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B 1738 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.12 130.61 40.65 Favored 'General case' 0 N--CA 1.478 0.956 0 CA-C-N 119.031 0.832 . . . . 0.0 112.604 176.734 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B 1739 ' ' ARG . . . . . . . . . . . . . 11.3 mmt-85 -158.38 151.0 22.16 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 127.396 2.279 . . . . 0.0 111.214 172.383 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B 1740 ' ' GLY . . . . . . . . . . . . . . . 82.66 152.65 11.37 Favored Glycine 0 CA--C 1.537 1.425 0 O-C-N 124.09 0.869 . . . . 0.0 113.211 175.198 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B 1741 ' ' ARG . . . . . . . . . . . . . 10.2 tpt180 -55.22 139.94 40.56 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 125.276 1.43 . . . . 0.0 113.177 -164.249 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B 1742 ' ' ASN . . . . . . . . . . . . . 20.4 p30 -140.25 -13.39 1.04 Allowed 'General case' 0 CA--C 1.55 0.947 0 N-CA-C 116.685 2.106 . . . . 0.0 116.685 179.682 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B 1743 ' ' LEU . . . . . . . . . . . . . 63.3 tp -54.24 121.49 8.31 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 125.273 1.429 . . . . 0.0 113.246 -175.692 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B 1744 ' ' THR . . . . . . . . . . . . 0.313 1.2 t . . . . . 0 C--O 1.254 1.319 0 N-CA-C 116.877 2.177 . . . . 0.0 116.877 -172.087 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 517' ' ' LEU . . . . . 0.492 HD22 HD22 ' A' ' 548' ' ' LEU . 14.1 mt . . . . . 0 CA--C 1.543 0.703 0 N-CA-C 112.23 0.456 . . . . 0.0 112.23 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -66.5 160.53 45.38 Favored 'Trans proline' 0 CA--C 1.537 0.631 0 C-N-CA 123.408 2.739 . . . . 0.0 113.401 -174.46 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 44.6 Cg_endo -59.05 133.15 51.43 Favored 'Trans proline' 0 N--CA 1.458 -0.564 0 C-N-CA 123.155 2.57 . . . . 0.0 110.656 -177.918 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 70.57 2.45 43.41 Favored Glycine 0 CA--C 1.537 1.451 0 CA-C-O 117.422 -1.765 . . . . 0.0 116.378 -178.803 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 19.6 t80 -34.6 131.61 0.34 Allowed 'General case' 0 CA--C 1.543 0.711 0 N-CA-C 117.76 2.504 . . . . 0.0 117.76 179.733 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 52.8 mtm -100.38 -57.02 2.21 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 -176.379 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 523' ' ' PHE . . . . . 0.481 ' CE1' HG21 ' A' ' 549' ' ' VAL . 32.7 p90 -167.58 173.7 8.38 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 127.963 2.505 . . . . 0.0 110.848 -176.093 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 524' ' ' LYS . . . . . 0.507 ' HE2' ' CD2' ' A' ' 548' ' ' LEU . 85.3 mttt -106.34 160.31 15.47 Favored 'General case' 0 N--CA 1.47 0.558 0 O-C-N 121.212 -0.93 . . . . 0.0 111.22 172.358 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 15.5 m -130.24 161.28 40.3 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 C-N-CA 126.184 1.794 . . . . 0.0 109.39 165.377 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 26.9 tt0 -127.41 128.83 46.46 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 119.541 1.064 . . . . 0.0 111.803 172.001 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 527' ' ' ALA . . . . . 0.407 ' HA ' HG22 ' A' ' 589' ' ' THR . . . -60.99 127.98 34.2 Favored 'General case' 0 CA--C 1.538 0.494 0 O-C-N 121.188 -0.945 . . . . 0.0 111.288 179.566 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 29.3 mm-40 -94.43 -25.75 16.78 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.49 1.516 . . . . 0.0 111.237 173.261 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 77.3 m-70 -135.66 162.9 31.43 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 127.444 2.298 . . . . 0.0 109.367 -178.652 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -90.51 143.31 26.87 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 121.117 -0.989 . . . . 0.0 113.29 177.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 89.6 t80 -136.25 125.29 24.37 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.978 1.311 . . . . 0.0 114.054 -177.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 3.5 m -96.92 120.64 37.64 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 113.785 1.032 . . . . 0.0 113.785 174.107 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -65.54 116.94 7.32 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-O 121.541 0.686 . . . . 0.0 111.901 -176.952 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 13.1 t -81.46 -28.54 34.11 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 123.897 0.879 . . . . 0.0 113.27 -173.82 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -140.36 176.72 8.54 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 116.268 1.951 . . . . 0.0 116.268 -165.343 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 536' ' ' THR . . . . . . . . . . . . 0.305 0.6 OUTLIER -75.84 -5.53 46.42 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 118.86 2.911 . . . . 0.0 118.86 -162.333 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . 0.389 1.6 p-10 -110.39 -10.22 14.59 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 115.832 1.79 . . . . 0.0 115.832 165.787 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 30.4 mp0 -80.4 145.2 32.11 Favored 'General case' 0 CA--C 1.557 1.238 0 N-CA-C 114.798 1.407 . . . . 0.0 114.798 -167.777 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -97.76 138.35 35.25 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 129.303 3.041 . . . . 0.0 110.699 -177.561 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 20.4 tt0 -90.49 135.0 33.97 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 123.958 0.903 . . . . 0.0 112.354 175.032 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 80.0 mt -126.75 145.75 50.49 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 125.159 1.384 . . . . 0.0 112.469 -179.691 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 9.9 tmtt? -112.32 141.2 46.33 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 125.34 1.456 . . . . 0.0 108.803 167.362 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -52.11 109.84 0.42 Allowed 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 118.888 0.767 . . . . 0.0 110.748 174.179 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 115.9 -8.81 18.91 Favored Glycine 0 CA--C 1.535 1.295 0 C-N-CA 125.797 1.665 . . . . 0.0 114.807 -174.651 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 64.5 m-20 -72.47 121.11 19.04 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 119.959 1.88 . . . . 0.0 114.279 -179.48 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 6.5 t -71.48 135.52 27.77 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 CA-C-N 118.688 0.676 . . . . 0.0 110.404 164.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -123.53 123.77 68.11 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.489 0 C-N-CA 125.813 1.645 . . . . 0.0 110.828 174.839 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 548' ' ' LEU . . . . . 0.507 ' CD2' ' HE2' ' A' ' 524' ' ' LYS . 21.6 mt -81.11 100.63 9.14 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 108.118 -1.067 . . . . 0.0 108.118 179.148 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 549' ' ' VAL . . . . . 0.481 HG21 ' CE1' ' A' ' 523' ' ' PHE . 5.7 t -60.43 130.02 23.72 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.166 0 N-CA-C 113.811 1.041 . . . . 0.0 113.811 174.31 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 10.2 pt -127.37 157.47 72.6 Favored Pre-proline 0 CA--C 1.549 0.936 0 C-N-CA 126.77 2.028 . . . . 0.0 110.514 177.263 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_endo -74.58 151.28 41.56 Favored 'Trans proline' 0 CA--C 1.54 0.812 0 C-N-CA 123.813 3.009 . . . . 0.0 111.729 172.402 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 552' ' ' PHE . . . . . 0.403 ' CE2' ' HA ' ' A' ' 558' ' ' GLN . 42.0 m-85 . . . . . 0 CA--C 1.539 0.523 0 N-CA-C 118.013 2.597 . . . . 0.0 118.013 -177.379 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 558' ' ' GLN . . . . . 0.403 ' HA ' ' CE2' ' A' ' 552' ' ' PHE . 33.9 tt0 . . . . . 0 C--O 1.235 0.321 0 CA-C-O 122.731 1.253 . . . . 0.0 111.739 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . 0.254 48.7 m-20 -71.82 139.21 48.84 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 125.587 1.555 . . . . 0.0 114.427 174.395 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -70.18 124.6 24.52 Favored 'General case' 0 CA--C 1.541 0.629 0 O-C-N 120.754 -1.216 . . . . 0.0 110.944 -174.046 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 84.79 1.08 89.11 Favored Glycine 0 CA--C 1.54 1.595 0 N-CA-C 115.089 0.796 . . . . 0.0 115.089 -171.536 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 46.4 m95 -102.34 163.76 12.05 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 125.194 1.398 . . . . 0.0 113.554 179.564 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 14.5 mt -132.89 150.59 52.15 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 125.724 1.609 . . . . 0.0 109.856 170.155 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 54.8 ttm -106.12 140.57 38.88 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 124.208 1.003 . . . . 0.0 112.03 170.017 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -166.17 -172.57 33.66 Favored Glycine 0 CA--C 1.522 0.52 0 C-N-CA 124.37 0.986 . . . . 0.0 112.797 173.748 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 14.5 p -130.35 140.99 47.44 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.551 0 C-N-CA 125.405 1.482 . . . . 0.0 108.9 169.473 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 39.8 mtmt -58.6 136.24 57.56 Favored 'General case' 0 CA--C 1.52 -0.174 0 O-C-N 121.53 -0.731 . . . . 0.0 111.44 176.489 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -60.63 -40.89 93.59 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 117.663 -1.16 . . . . 0.0 111.783 -178.74 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 57.4 m -68.84 -35.59 77.14 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 120.52 1.509 . . . . 0.0 111.878 176.649 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -58.59 -33.11 69.62 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 114.05 1.129 . . . . 0.0 114.05 171.793 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 62.9 t-105 -84.77 -34.48 22.79 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.798 1.639 . . . . 0.0 113.888 174.709 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 7.8 t-20 -71.42 -22.0 61.91 Favored 'General case' 0 CA--C 1.552 1.023 0 C-N-CA 126.671 1.989 . . . . 0.0 111.984 175.006 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 41.4 mt-30 -85.55 -5.76 59.25 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 126.266 1.826 . . . . 0.0 113.04 167.083 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 21.7 m-70 58.49 38.38 25.53 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 127.392 2.277 . . . . 0.0 113.255 172.86 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 71.9 mttt -75.14 166.06 24.25 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 126.33 1.852 . . . . 0.0 112.476 177.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 3.2 pm0 -51.25 96.73 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 126.043 1.737 . . . . 0.0 114.644 177.685 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 42.8 tp -55.7 -49.32 73.32 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 126.057 1.743 . . . . 0.0 112.448 -170.079 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 64.0 mt-10 -67.73 -13.08 61.81 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 114.521 1.304 . . . . 0.0 114.521 -176.142 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 43.7 mmtm -105.18 -25.13 12.6 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 125.569 1.548 . . . . 0.0 112.898 172.466 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 90.3 m -82.61 -28.18 30.98 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 114.117 1.154 . . . . 0.0 114.117 178.109 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 36.4 ptt180 -70.24 161.65 29.91 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 124.454 1.102 . . . . 0.0 112.917 176.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -173.91 174.79 46.41 Favored Glycine 0 N--CA 1.468 0.812 0 C-N-CA 124.651 1.12 . . . . 0.0 114.493 176.526 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 13.1 m -93.27 137.33 22.77 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 C-N-CA 125.065 1.346 . . . . 0.0 112.7 172.033 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 39.8 p90 -132.33 155.68 80.99 Favored Pre-proline 0 CA--C 1.539 0.553 0 C-N-CA 125.098 1.359 . . . . 0.0 114.004 178.004 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 62.6 Cg_endo -66.75 107.82 1.34 Allowed 'Trans proline' 0 N--CA 1.458 -0.616 0 C-N-CA 122.49 2.127 . . . . 0.0 109.87 168.813 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 17.6 pt-20 -51.8 -30.06 21.66 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 124.558 1.143 . . . . 0.0 113.11 178.912 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 11.9 p-10 -70.67 -13.99 62.29 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 126.842 2.057 . . . . 0.0 114.33 179.437 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 9.9 m-85 -76.52 -14.62 60.01 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 116.384 1.994 . . . . 0.0 116.384 165.697 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 589' ' ' THR . . . . . 0.407 HG22 ' HA ' ' A' ' 527' ' ' ALA . 71.0 p -121.07 173.22 7.41 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 125.617 1.567 . . . . 0.0 111.871 -174.333 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -125.18 140.44 52.86 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 124.175 0.99 . . . . 0.0 110.195 171.417 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 15.4 tpt180 -62.97 114.74 3.86 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 124.682 1.193 . . . . 0.0 110.014 171.122 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 592' ' ' VAL . . . . . 0.44 HG23 ' HB2' ' A' ' 524' ' ' LYS . 2.0 m . . . . . 0 N--CA 1.476 0.861 0 C-N-CA 124.521 1.128 . . . . 0.0 108.87 177.328 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 79.7 Cg_endo . . . . . 0 CA--C 1.542 0.91 0 N-CA-C 113.185 0.417 . . . . 0.0 113.185 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 11.8 t -132.12 128.27 58.87 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.12 0 C-N-CA 124.904 1.281 . . . . 0.0 112.71 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -67.21 136.63 93.85 Favored Pre-proline 0 CA--C 1.549 0.94 0 O-C-N 121.389 -0.82 . . . . 0.0 112.633 -176.896 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -77.41 162.28 30.92 Favored 'Trans proline' 0 CA--C 1.548 1.183 0 C-N-CA 123.032 2.488 . . . . 0.0 113.561 -175.559 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 61.8 Cg_endo . . . . . 0 CA--C 1.54 0.794 0 C-N-CA 123.447 2.765 . . . . 0.0 112.909 -178.709 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 517' ' ' LEU . . . . . 0.48 HD22 HD22 ' A' ' 548' ' ' LEU . 12.1 mt . . . . . 0 CA--C 1.537 0.469 0 N-CA-C 111.213 0.079 . . . . 0.0 111.213 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -64.47 159.48 44.09 Favored 'Trans proline' 0 N--CA 1.458 -0.591 0 C-N-CA 122.986 2.457 . . . . 0.0 112.94 -174.178 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -62.5 135.58 54.06 Favored 'Trans proline' 0 N--CA 1.457 -0.662 0 C-N-CA 122.503 2.135 . . . . 0.0 109.89 177.318 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 77.57 -3.69 58.76 Favored Glycine 0 CA--C 1.531 1.06 0 CA-C-O 117.358 -1.801 . . . . 0.0 115.217 -179.762 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 32.8 t80 -34.64 125.05 0.53 Allowed 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 117.202 2.297 . . . . 0.0 117.202 -176.781 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 45.7 mtm -94.45 -51.43 4.77 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 112.241 0.46 . . . . 0.0 112.241 -178.019 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 523' ' ' PHE . . . . . . . . . . . . . 22.6 p90 -171.0 167.12 7.35 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 127.645 2.378 . . . . 0.0 112.609 -172.072 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 524' ' ' LYS . . . . . 0.473 ' HB2' HG23 ' A' ' 592' ' ' VAL . 72.1 mttt -96.81 160.27 14.46 Favored 'General case' 0 CA--C 1.534 0.332 0 O-C-N 121.234 -0.916 . . . . 0.0 111.027 166.699 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 32.1 m -134.56 158.49 41.77 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 C-N-CA 126.297 1.839 . . . . 0.0 108.614 166.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 40.1 tt0 -125.43 130.16 51.29 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-N 119.327 0.967 . . . . 0.0 112.343 173.989 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 527' ' ' ALA . . . . . 0.558 ' HA ' HG22 ' A' ' 589' ' ' THR . . . -64.98 117.9 8.3 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 124.488 1.115 . . . . 0.0 111.426 -177.669 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 75.7 mm-40 -80.87 -29.13 35.8 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 123.474 0.709 . . . . 0.0 111.459 173.497 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 97.8 m-70 -136.83 160.11 39.84 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 125.894 1.678 . . . . 0.0 111.295 -177.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . 0.312 4.6 p30 -82.33 136.36 35.03 Favored 'General case' 0 CA--C 1.546 0.807 0 N-CA-C 115.651 1.723 . . . . 0.0 115.651 178.817 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 82.3 t80 -140.26 128.75 22.78 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 126.095 1.758 . . . . 0.0 112.955 -178.551 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 2.6 m -104.17 135.77 45.03 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 124.864 1.266 . . . . 0.0 113.985 175.501 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -73.23 126.77 30.85 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 112.85 0.685 . . . . 0.0 112.85 -173.452 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 2.8 p -90.96 -3.66 57.12 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 127.757 2.423 . . . . 0.0 116.051 177.669 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 24.6 t0 -148.97 159.47 44.17 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.383 1.473 . . . . 0.0 107.878 -170.225 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 2.0 t -67.24 -20.86 65.73 Favored 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 115.048 1.499 . . . . 0.0 115.048 169.448 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 13.8 t0 -82.53 -20.36 36.8 Favored 'General case' 0 CA--C 1.551 0.986 0 C-N-CA 123.349 0.66 . . . . 0.0 110.426 177.562 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 72.1 mt-10 -82.13 153.12 26.2 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 125.252 1.421 . . . . 0.0 114.744 -173.867 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -98.54 139.1 34.78 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 127.684 2.393 . . . . 0.0 110.307 176.668 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 14.3 tt0 -91.38 130.88 37.17 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.001 0.92 . . . . 0.0 111.07 172.233 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 73.4 mt -128.61 139.96 52.01 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 124.939 1.296 . . . . 0.0 112.245 -177.535 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 14.3 tmtt? -110.55 145.7 37.33 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 126.257 1.823 . . . . 0.0 109.872 171.177 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -59.21 94.24 0.02 OUTLIER 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 124.231 1.013 . . . . 0.0 112.5 177.675 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 131.45 -8.81 5.6 Favored Glycine 0 CA--C 1.532 1.099 0 C-N-CA 126.522 2.01 . . . . 0.0 114.758 -173.399 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 86.2 m-20 -70.7 122.22 19.41 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 119.766 1.783 . . . . 0.0 114.248 -178.547 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 3.4 t -72.2 135.96 26.71 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.415 0 CA-C-N 118.378 0.535 . . . . 0.0 110.546 163.281 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 1.3 t -125.1 123.78 66.1 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.453 0 C-N-CA 126.749 2.02 . . . . 0.0 110.607 177.052 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 548' ' ' LEU . . . . . 0.48 HD22 HD22 ' A' ' 517' ' ' LEU . 26.7 mt -81.38 98.69 8.32 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 108.15 -1.056 . . . . 0.0 108.15 177.752 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 549' ' ' VAL . . . . . . . . . . . . . 5.9 t -62.93 132.05 28.62 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.132 0 N-CA-C 114.315 1.228 . . . . 0.0 114.315 175.277 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 15.0 pt -126.63 154.72 75.53 Favored Pre-proline 0 CA--C 1.546 0.807 0 C-N-CA 126.502 1.921 . . . . 0.0 110.395 176.865 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 89.4 Cg_endo -75.69 142.37 25.76 Favored 'Trans proline' 0 C--O 1.241 0.645 0 C-N-CA 123.901 3.067 . . . . 0.0 111.807 177.465 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 48.4 m-85 . . . . . 0 CA--C 1.537 0.478 0 N-CA-C 115.552 1.686 . . . . 0.0 115.552 178.757 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 48.2 tt0 . . . . . 0 C--O 1.236 0.346 0 CA-C-O 121.837 0.827 . . . . 0.0 112.388 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 56.2 m-20 -82.67 141.81 32.18 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 125.262 1.425 . . . . 0.0 109.324 175.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 87.4 tt0 -76.94 125.94 30.15 Favored 'General case' 0 N--CA 1.471 0.59 0 O-C-N 120.633 -1.292 . . . . 0.0 110.543 -176.181 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 84.64 7.81 83.84 Favored Glycine 0 CA--C 1.537 1.466 0 CA-C-O 118.869 -0.962 . . . . 0.0 114.978 -171.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 43.3 m95 -111.7 155.97 22.62 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 125.709 1.603 . . . . 0.0 114.016 -179.6 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 12.6 mt -123.96 159.3 30.07 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.384 1.073 . . . . 0.0 110.725 172.098 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 51.9 ttm -118.32 143.25 46.75 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 125.051 1.341 . . . . 0.0 111.383 173.004 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -173.56 -167.54 33.43 Favored Glycine 0 CA--C 1.525 0.707 0 C-N-CA 124.256 0.931 . . . . 0.0 112.741 178.277 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 14.7 p -136.03 142.02 40.06 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 C-N-CA 125.378 1.471 . . . . 0.0 109.342 172.738 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 36.4 mtmt -58.1 135.09 56.96 Favored 'General case' 0 N--CA 1.468 0.475 0 O-C-N 121.338 -0.851 . . . . 0.0 110.876 174.989 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -59.41 -39.49 83.61 Favored 'General case' 0 C--O 1.221 -0.43 0 CA-C-O 117.711 -1.138 . . . . 0.0 111.349 177.35 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 7.6 t -68.14 -35.39 78.0 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 120.294 1.406 . . . . 0.0 111.239 179.396 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 83.8 m-20 -65.1 -33.48 76.13 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 115.184 1.55 . . . . 0.0 115.184 171.9 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 58.4 t-105 -83.72 -32.14 25.67 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 125.08 1.352 . . . . 0.0 113.235 175.505 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 18.4 t-20 -75.2 -14.02 60.5 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 127.133 2.173 . . . . 0.0 111.982 172.47 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 8.6 mm-40 -82.45 -4.78 58.02 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 126.676 1.99 . . . . 0.0 113.846 162.705 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 574' ' ' HIS . . . . . . . . . . . . 0.251 69.4 m-70 57.47 27.92 14.7 Favored 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 126.268 1.827 . . . . 0.0 114.735 -179.376 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 22.4 mtpp -72.35 161.82 30.31 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 126.322 1.849 . . . . 0.0 112.893 179.293 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -59.88 105.05 0.34 Allowed 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.184 1.394 . . . . 0.0 113.546 179.109 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 58.6 tp -56.95 -42.58 80.37 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 126.017 1.727 . . . . 0.0 112.283 -174.528 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 15.2 pm0 -55.96 -33.07 64.44 Favored 'General case' 0 CA--C 1.542 0.662 0 N-CA-C 114.545 1.313 . . . . 0.0 114.545 178.257 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 2.0 tppp? -88.98 -43.48 11.1 Favored 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 125.447 1.499 . . . . 0.0 110.786 177.924 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 87.2 m -74.83 -24.54 58.62 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 126.457 1.903 . . . . 0.0 115.146 -173.474 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 46.9 ptt85 -63.56 165.62 7.81 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 125.035 1.334 . . . . 0.0 113.585 177.598 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -172.6 174.9 45.76 Favored Glycine 0 CA--C 1.525 0.701 0 CA-C-N 115.031 -0.986 . . . . 0.0 114.639 165.534 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 32.7 m -91.97 144.51 9.11 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 C-N-CA 124.264 1.026 . . . . 0.0 111.085 166.221 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 38.3 p90 -138.24 154.38 73.85 Favored Pre-proline 0 CA--C 1.539 0.543 0 C-N-CA 125.02 1.328 . . . . 0.0 113.055 177.183 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 65.2 Cg_endo -66.71 108.79 1.51 Allowed 'Trans proline' 0 N--CA 1.457 -0.649 0 C-N-CA 121.786 1.657 . . . . 0.0 109.141 170.259 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -58.83 -21.57 56.92 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 124.01 0.924 . . . . 0.0 113.27 -178.717 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 10.5 p-10 -73.45 -8.19 54.85 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 125.752 1.621 . . . . 0.0 114.16 174.147 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 13.0 m-85 -82.7 -16.5 47.9 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 116.047 1.869 . . . . 0.0 116.047 168.036 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 589' ' ' THR . . . . . 0.558 HG22 ' HA ' ' A' ' 527' ' ' ALA . 17.7 p -122.13 -179.99 4.35 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.449 1.5 . . . . 0.0 108.452 -172.112 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -140.92 142.55 34.41 Favored 'General case' 0 CA--C 1.536 0.429 0 O-C-N 120.721 -1.237 . . . . 0.0 110.23 171.021 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -52.37 135.73 32.58 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 125.407 1.483 . . . . 0.0 110.811 172.968 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 592' ' ' VAL . . . . . 0.473 HG23 ' HB2' ' A' ' 524' ' ' LYS . 1.7 m . . . . . 0 N--CA 1.475 0.816 0 C-N-CA 125.574 1.55 . . . . 0.0 109.412 175.055 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo . . . . . 0 CA--C 1.54 0.792 0 CA-C-O 121.967 0.736 . . . . 0.0 113.865 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 6.8 p -135.05 126.36 46.45 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.706 0 C-N-CA 126.364 1.865 . . . . 0.0 110.387 -177.692 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -65.49 135.9 95.99 Favored Pre-proline 0 CA--C 1.546 0.801 0 O-C-N 121.172 -0.955 . . . . 0.0 111.778 -175.515 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 4.5 Cg_endo -69.07 162.81 40.19 Favored 'Trans proline' 0 CA--C 1.539 0.752 0 C-N-CA 122.292 1.995 . . . . 0.0 112.179 177.896 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo . . . . . 0 CA--C 1.538 0.696 0 C-N-CA 122.537 2.158 . . . . 0.0 111.842 168.345 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 517' ' ' LEU . . . . . 0.415 HD22 HD22 ' A' ' 548' ' ' LEU . 11.0 mt . . . . . 0 CA--C 1.542 0.652 0 CA-C-O 120.555 0.217 . . . . 0.0 111.517 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_endo -68.06 159.36 53.39 Favored 'Trans proline' 0 CA--C 1.54 0.796 0 C-N-CA 123.458 2.772 . . . . 0.0 113.709 -173.768 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -62.92 126.78 18.78 Favored 'Trans proline' 0 C--N 1.347 0.492 0 C-N-CA 123.763 2.976 . . . . 0.0 111.182 -178.44 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 78.72 1.19 83.02 Favored Glycine 0 CA--C 1.533 1.172 0 CA-C-O 117.385 -1.786 . . . . 0.0 115.653 -177.265 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 27.1 t80 -34.84 137.22 0.13 Allowed 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 117.192 2.293 . . . . 0.0 117.192 179.222 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 39.6 mtm -106.29 -61.85 1.46 Allowed 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 123.891 0.876 . . . . 0.0 111.928 -178.073 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 523' ' ' PHE . . . . . . . . . . . . . 23.9 p90 -161.06 170.17 21.02 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 127.28 2.232 . . . . 0.0 112.082 -172.724 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 524' ' ' LYS . . . . . 0.603 ' HB2' HG23 ' A' ' 592' ' ' VAL . 71.9 mttt -104.9 163.83 12.24 Favored 'General case' 0 N--CA 1.467 0.399 0 O-C-N 121.148 -0.97 . . . . 0.0 111.288 170.358 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 8.3 m -132.4 156.53 42.5 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.881 0 C-N-CA 126.299 1.84 . . . . 0.0 109.651 165.894 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 44.2 tt0 -118.38 129.87 55.67 Favored 'General case' 0 N--CA 1.477 0.877 0 CA-C-N 119.795 1.18 . . . . 0.0 111.913 169.394 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 527' ' ' ALA . . . . . 0.513 ' HA ' HG22 ' A' ' 589' ' ' THR . . . -62.11 121.8 13.96 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.155 0.982 . . . . 0.0 111.786 177.766 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 71.7 mm-40 -89.49 -18.15 27.26 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 125.957 1.703 . . . . 0.0 111.978 172.978 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 98.7 m-70 -144.93 161.5 39.2 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 127.577 2.351 . . . . 0.0 109.759 -175.443 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -89.5 133.06 34.74 Favored 'General case' 0 C--O 1.237 0.429 0 N-CA-C 107.079 -1.452 . . . . 0.0 107.079 -179.524 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 88.2 t80 -122.61 106.19 10.76 Favored 'General case' 0 C--O 1.235 0.306 0 C-N-CA 124.772 1.229 . . . . 0.0 113.232 177.59 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -80.6 113.84 19.07 Favored 'General case' 0 N--CA 1.469 0.503 0 N-CA-C 113.251 0.834 . . . . 0.0 113.251 170.071 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -71.47 141.63 50.21 Favored 'General case' 0 C--O 1.238 0.485 0 C-N-CA 125.244 1.418 . . . . 0.0 111.881 179.747 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 5.7 t -110.65 -37.01 5.57 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 126.178 1.791 . . . . 0.0 113.455 177.92 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 84.8 m-20 -95.11 152.48 18.31 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 116.968 2.21 . . . . 0.0 116.968 -177.547 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 4.2 t -57.12 -26.89 61.24 Favored 'General case' 0 N--CA 1.481 1.084 0 N-CA-C 116.138 1.903 . . . . 0.0 116.138 179.812 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 8.2 p30 -92.61 -9.37 41.27 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 116.788 2.144 . . . . 0.0 116.788 174.742 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 86.3 mt-10 -75.69 152.11 37.58 Favored 'General case' 0 CA--C 1.537 0.457 0 O-C-N 120.96 -1.088 . . . . 0.0 113.913 -177.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -97.97 132.48 43.5 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 127.561 2.344 . . . . 0.0 109.521 171.577 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 30.0 tt0 -90.03 134.45 34.23 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.037 0.935 . . . . 0.0 111.519 174.912 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 83.1 mt -127.63 155.36 44.0 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 125.007 1.323 . . . . 0.0 112.819 -178.196 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -129.12 142.31 50.92 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 125.556 1.542 . . . . 0.0 109.728 174.029 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -54.8 105.89 0.18 Allowed 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.34 1.056 . . . . 0.0 112.04 -175.616 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 125.43 -15.01 7.24 Favored Glycine 0 CA--C 1.531 1.061 0 C-N-CA 126.684 2.087 . . . . 0.0 113.814 -176.627 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 84.9 m-20 -73.83 119.64 18.33 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 114.909 1.448 . . . . 0.0 114.909 -171.164 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 21.8 t -70.14 137.78 23.34 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 O-C-N 122.057 -0.402 . . . . 0.0 110.83 169.178 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 1.1 t -125.84 127.55 71.36 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 C-N-CA 126.538 1.935 . . . . 0.0 111.399 174.957 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 548' ' ' LEU . . . . . 0.439 ' CD2' ' HE2' ' A' ' 524' ' ' LYS . 20.4 mt -83.76 101.7 11.78 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.356 1.063 . . . . 0.0 108.742 177.495 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 549' ' ' VAL . . . . . . . . . . . . . 6.3 t -63.88 131.12 29.43 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 N-CA-C 113.986 1.106 . . . . 0.0 113.986 174.436 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 24.6 pt -127.11 157.25 72.79 Favored Pre-proline 0 CA--C 1.548 0.87 0 C-N-CA 126.426 1.89 . . . . 0.0 110.276 177.606 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -70.93 156.43 60.3 Favored 'Trans proline' 0 CA--C 1.534 0.519 0 C-N-CA 123.779 2.986 . . . . 0.0 111.54 174.498 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 54.9 m-85 . . . . . 0 CA--C 1.537 0.471 0 N-CA-C 115.72 1.748 . . . . 0.0 115.72 175.998 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 4.1 tp60 . . . . . 0 N--CA 1.476 0.843 0 N-CA-C 113.178 0.807 . . . . 0.0 113.178 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 13.0 m-20 -120.3 156.29 31.56 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 128.173 2.589 . . . . 0.0 116.125 178.66 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -71.31 110.86 6.21 Favored 'General case' 0 N--CA 1.473 0.716 0 O-C-N 120.345 -1.472 . . . . 0.0 114.093 -165.783 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 82.69 7.63 87.13 Favored Glycine 0 CA--C 1.539 1.545 0 O-C-N 121.117 -0.989 . . . . 0.0 114.605 -175.415 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 47.6 m95 -89.64 165.96 13.91 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 126.013 1.725 . . . . 0.0 113.456 176.407 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 18.9 mt -138.48 158.05 45.0 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 126.003 1.721 . . . . 0.0 110.317 170.4 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 47.8 ttm -115.32 142.78 46.23 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 125.058 1.343 . . . . 0.0 112.078 174.011 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -171.8 -174.8 39.61 Favored Glycine 0 CA--C 1.527 0.812 0 C-N-CA 123.771 0.701 . . . . 0.0 113.328 178.056 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 12.1 p -128.11 141.23 47.02 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.829 0 C-N-CA 125.742 1.617 . . . . 0.0 109.15 171.384 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 31.8 mtmt -57.72 136.56 56.89 Favored 'General case' 0 N--CA 1.467 0.411 0 O-C-N 121.328 -0.858 . . . . 0.0 111.563 175.519 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 15.9 tt0 -58.06 -43.58 86.99 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 118.555 -0.736 . . . . 0.0 110.909 176.809 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 38.5 t -65.68 -36.25 83.1 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-N 118.932 0.787 . . . . 0.0 112.583 178.172 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 79.4 m-20 -65.3 -42.53 92.97 Favored 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 114.828 1.418 . . . . 0.0 114.828 173.515 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 72.9 t-105 -69.04 -35.55 76.72 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.564 1.146 . . . . 0.0 112.92 173.914 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 50.9 t-20 -69.06 -31.35 70.05 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 127.429 2.292 . . . . 0.0 111.737 173.891 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 12.5 mm-40 -82.45 0.74 40.84 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.966 1.306 . . . . 0.0 114.149 172.373 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 83.6 m-70 57.26 38.31 28.63 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 126.753 2.021 . . . . 0.0 113.706 178.268 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 22.3 mtpp -86.31 159.05 19.53 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 125.595 1.558 . . . . 0.0 111.043 179.881 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 12.6 pm0 -56.49 98.71 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 115.029 1.492 . . . . 0.0 115.029 -167.179 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 44.6 tp -50.64 -47.18 58.53 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 125.042 1.337 . . . . 0.0 112.665 -173.229 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 72.4 mm-40 -66.27 -12.64 57.62 Favored 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 114.371 1.248 . . . . 0.0 114.371 -174.124 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 13.1 tptp -117.83 -33.16 4.59 Favored 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 125.501 1.521 . . . . 0.0 113.173 177.684 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 71.1 m -65.22 -31.83 73.19 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 125.635 1.574 . . . . 0.0 112.504 173.119 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 29.6 ptt85 -60.1 157.07 13.73 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 123.737 0.815 . . . . 0.0 112.668 172.215 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -171.96 173.91 45.21 Favored Glycine 0 CA--C 1.524 0.62 0 C-N-CA 123.991 0.805 . . . . 0.0 113.205 173.707 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 35.1 m -91.37 141.43 14.47 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.428 0 C-N-CA 124.008 0.923 . . . . 0.0 110.982 169.356 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 50.5 p90 -137.74 154.6 74.89 Favored Pre-proline 0 CA--C 1.538 0.498 0 C-N-CA 123.959 0.903 . . . . 0.0 113.125 175.838 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_endo -70.37 110.07 2.59 Favored 'Trans proline' 0 N--CA 1.458 -0.613 0 C-N-CA 122.207 1.938 . . . . 0.0 110.034 172.11 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 20.8 pt-20 -55.83 -26.53 47.08 Favored 'General case' 0 N--CA 1.474 0.756 0 O-C-N 121.308 -0.87 . . . . 0.0 112.675 -178.805 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 6.6 p-10 -65.35 -15.36 62.48 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 126.131 1.772 . . . . 0.0 114.48 178.199 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 27.5 m-85 -77.48 -10.99 59.79 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 116.582 2.068 . . . . 0.0 116.582 165.537 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 589' ' ' THR . . . . . 0.513 HG22 ' HA ' ' A' ' 527' ' ' ALA . 80.6 p -131.27 169.78 15.5 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 126.131 1.772 . . . . 0.0 111.734 -171.806 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -125.23 142.45 51.49 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 123.987 0.915 . . . . 0.0 110.228 172.23 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.55 134.5 56.18 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 125.252 1.421 . . . . 0.0 110.999 172.009 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 592' ' ' VAL . . . . . 0.603 HG23 ' HB2' ' A' ' 524' ' ' LYS . 5.4 m . . . . . 0 CA--C 1.553 1.06 0 C-N-CA 124.785 1.234 . . . . 0.0 111.584 -178.546 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 49.8 Cg_endo . . . . . 0 CA--C 1.547 1.125 0 N-CA-C 115.25 1.212 . . . . 0.0 115.25 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 60.3 t -132.65 129.87 58.93 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.068 0 C-N-CA 125.9 1.68 . . . . 0.0 110.73 178.572 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -65.08 131.41 95.15 Favored Pre-proline 0 CA--C 1.556 1.185 0 O-C-N 121.481 -0.762 . . . . 0.0 112.924 -177.348 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 50.4 Cg_endo -74.06 157.3 46.83 Favored 'Trans proline' 0 CA--C 1.541 0.842 0 C-N-CA 123.105 2.537 . . . . 0.0 114.111 -170.15 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo . . . . . 0 CA--C 1.535 0.56 0 C-N-CA 123.808 3.005 . . . . 0.0 112.802 -172.291 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 517' ' ' LEU . . . . . 0.408 HD22 HD22 ' A' ' 548' ' ' LEU . 10.6 mt . . . . . 0 CA--C 1.552 1.042 0 N-CA-C 114.61 1.337 . . . . 0.0 114.61 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -71.0 161.14 47.12 Favored 'Trans proline' 0 CA--C 1.541 0.867 0 C-N-CA 124.655 3.57 . . . . 0.0 113.981 -172.205 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -68.19 123.95 11.19 Favored 'Trans proline' 0 C--O 1.239 0.542 0 C-N-CA 123.481 2.787 . . . . 0.0 111.818 -173.488 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 82.15 1.53 90.37 Favored Glycine 0 CA--C 1.537 1.415 0 CA-C-O 117.757 -1.579 . . . . 0.0 115.808 -175.454 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 30.6 t80 -34.18 132.02 0.28 Allowed 'General case' 0 CA--C 1.546 0.808 0 N-CA-C 118.435 2.754 . . . . 0.0 118.435 -178.53 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 31.7 mtm -101.59 -53.93 2.87 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 113.479 0.918 . . . . 0.0 113.479 -176.732 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 523' ' ' PHE . . . . . 0.46 ' CE1' HG21 ' A' ' 549' ' ' VAL . 19.3 p90 -170.02 171.09 7.21 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 126.508 1.923 . . . . 0.0 111.893 -173.299 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 524' ' ' LYS . . . . . 0.516 ' HE2' ' CD2' ' A' ' 548' ' ' LEU . 76.5 mttt -104.61 163.21 12.64 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-O 122.228 1.013 . . . . 0.0 111.684 167.904 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 12.3 m -134.34 162.44 39.01 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 126.552 1.941 . . . . 0.0 109.55 165.317 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 52.5 tt0 -127.28 129.8 48.38 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 119.035 0.834 . . . . 0.0 112.137 171.136 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 527' ' ' ALA . . . . . 0.569 ' HA ' HG22 ' A' ' 589' ' ' THR . . . -62.84 129.62 41.27 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.119 0.967 . . . . 0.0 111.302 -178.644 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 62.6 mm-40 -98.08 -12.8 21.46 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 124.915 1.286 . . . . 0.0 112.708 173.461 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 89.0 m-70 -146.74 160.14 42.6 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 128.064 2.545 . . . . 0.0 109.243 -179.87 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 21.4 p-10 -78.53 146.14 34.47 Favored 'General case' 0 N--CA 1.466 0.375 0 O-C-N 121.432 -0.792 . . . . 0.0 111.853 170.061 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 79.3 t80 -139.72 118.27 12.24 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 124.999 1.32 . . . . 0.0 110.846 175.71 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 2.2 m -91.57 132.14 36.51 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 124.909 1.284 . . . . 0.0 113.883 173.546 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -71.19 120.83 17.33 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 123.584 0.754 . . . . 0.0 112.321 -171.208 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 2.4 p -89.23 -5.53 57.58 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 126.216 1.807 . . . . 0.0 115.763 177.595 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 8.6 t0 -147.21 158.79 44.08 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.266 1.026 . . . . 0.0 108.905 178.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 6.3 t -59.79 -23.08 62.99 Favored 'General case' 0 N--CA 1.477 0.914 0 N-CA-C 115.061 1.504 . . . . 0.0 115.061 169.567 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 23.3 t0 -75.62 -33.75 60.54 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 124.512 1.125 . . . . 0.0 110.686 174.771 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 83.6 mt-10 -73.57 147.22 44.11 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.011 1.325 . . . . 0.0 113.345 -171.071 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -92.52 138.16 31.75 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 127.275 2.23 . . . . 0.0 109.825 175.123 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 14.0 tt0 -94.07 119.54 33.07 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 123.956 0.902 . . . . 0.0 111.316 175.492 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 59.5 mt -111.59 142.17 44.23 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 124.447 1.099 . . . . 0.0 111.76 179.272 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 16.0 tptp -106.18 142.19 36.29 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 124.737 1.215 . . . . 0.0 109.816 162.498 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -47.49 121.55 4.03 Favored 'General case' 0 CA--C 1.544 0.726 0 CA-C-O 121.657 0.742 . . . . 0.0 110.881 173.66 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 98.05 -3.81 60.51 Favored Glycine 0 CA--C 1.53 0.998 0 C-N-CA 125.191 1.377 . . . . 0.0 114.127 -178.715 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 82.0 m-20 -67.5 122.11 17.27 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 118.798 1.299 . . . . 0.0 114.228 174.854 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 2.3 t -74.89 135.19 27.84 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 CA-C-N 118.554 0.615 . . . . 0.0 111.552 165.889 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -125.31 121.5 60.69 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 C-N-CA 125.443 1.497 . . . . 0.0 111.744 177.494 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 548' ' ' LEU . . . . . 0.516 ' CD2' ' HE2' ' A' ' 524' ' ' LYS . 17.8 mt -77.13 99.28 5.33 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.609 1.164 . . . . 0.0 108.595 175.241 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 549' ' ' VAL . . . . . 0.46 HG21 ' CE1' ' A' ' 523' ' ' PHE . 2.8 t -60.58 128.48 21.79 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.955 0 N-CA-C 114.011 1.115 . . . . 0.0 114.011 171.142 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 8.7 pt -123.82 154.06 67.22 Favored Pre-proline 0 CA--C 1.547 0.852 0 C-N-CA 126.438 1.895 . . . . 0.0 109.749 177.485 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -70.6 148.9 60.66 Favored 'Trans proline' 0 N--CA 1.461 -0.429 0 C-N-CA 123.653 2.902 . . . . 0.0 110.129 173.862 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 46.7 m-85 . . . . . 0 CA--C 1.535 0.388 0 N-CA-C 114.386 1.254 . . . . 0.0 114.386 176.075 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 50.6 tt0 . . . . . 0 C--O 1.234 0.25 0 CA-C-O 121.962 0.887 . . . . 0.0 112.722 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 68.9 m-20 -94.24 151.82 19.16 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 125.328 1.451 . . . . 0.0 114.109 177.775 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 80.7 tt0 -82.28 119.16 23.75 Favored 'General case' 0 CA--C 1.541 0.597 0 O-C-N 121.053 -1.029 . . . . 0.0 111.907 -167.866 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 81.94 1.58 90.31 Favored Glycine 0 CA--C 1.543 1.797 0 C-N-CA 124.327 0.965 . . . . 0.0 114.834 -171.352 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 47.5 m95 -94.38 167.01 11.79 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 126.78 2.032 . . . . 0.0 113.253 176.45 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 22.7 mt -139.56 159.7 41.55 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 125.192 1.397 . . . . 0.0 110.887 169.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 46.0 ttm -115.17 143.84 44.6 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 125.501 1.52 . . . . 0.0 112.712 176.238 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -167.34 -173.44 35.53 Favored Glycine 0 CA--C 1.525 0.705 0 C-N-CA 124.057 0.837 . . . . 0.0 113.374 175.063 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 14.3 p -129.84 142.03 44.9 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 C-N-CA 125.836 1.655 . . . . 0.0 109.477 170.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 34.0 mtmt -59.04 132.61 54.56 Favored 'General case' 0 N--CA 1.467 0.421 0 O-C-N 121.428 -0.795 . . . . 0.0 111.929 176.189 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 18.3 tt0 -59.42 -42.61 92.23 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 118.473 -0.775 . . . . 0.0 111.124 178.758 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 34.0 t -65.31 -30.79 71.68 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 119.254 0.934 . . . . 0.0 111.963 178.699 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -70.6 -40.77 73.02 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 115.086 1.513 . . . . 0.0 115.086 173.1 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 64.3 t-105 -71.06 -30.42 66.56 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.217 1.407 . . . . 0.0 112.992 172.116 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 10.1 t-20 -67.52 -34.03 76.28 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 126.472 1.909 . . . . 0.0 111.585 172.161 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 35.4 mt-30 -80.77 -0.07 36.98 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 124.886 1.275 . . . . 0.0 113.44 168.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 9.0 m-70 53.78 37.43 26.31 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 126.061 1.744 . . . . 0.0 112.943 179.444 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 6.0 mtpm? -73.17 156.46 38.59 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 125.05 1.34 . . . . 0.0 110.854 175.882 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 12.1 pm0 -57.35 105.79 0.27 Allowed 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 125.038 1.335 . . . . 0.0 114.159 -167.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 55.2 tp -55.25 -48.15 74.39 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 124.505 1.122 . . . . 0.0 112.814 -170.139 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 1.2 pp20? -66.29 -16.45 64.05 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 125.253 1.421 . . . . 0.0 114.651 -175.401 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 32.3 mmtm -106.74 -37.51 6.38 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.681 1.193 . . . . 0.0 112.671 173.213 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 91.2 m -68.47 -28.57 67.15 Favored 'General case' 0 CA--C 1.537 0.479 0 N-CA-C 112.93 0.715 . . . . 0.0 112.93 -179.816 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 38.4 ptt85 -64.29 156.99 27.24 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 113.223 0.823 . . . . 0.0 113.223 176.757 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -169.85 171.04 43.18 Favored Glycine 0 N--CA 1.466 0.697 0 CA-C-N 115.765 -0.652 . . . . 0.0 114.52 176.354 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 17.4 m -90.44 137.16 22.17 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 C-N-CA 124.753 1.221 . . . . 0.0 112.236 172.403 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 48.0 p90 -135.15 155.29 79.07 Favored Pre-proline 0 C--O 1.241 0.629 0 C-N-CA 124.502 1.121 . . . . 0.0 112.932 176.832 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_endo -69.83 109.2 2.27 Favored 'Trans proline' 0 N--CA 1.455 -0.785 0 C-N-CA 121.773 1.649 . . . . 0.0 109.359 169.84 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 20.3 pt-20 -54.41 -23.5 16.08 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 124.16 0.984 . . . . 0.0 113.578 -179.805 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 9.7 p-10 -77.84 -11.29 59.87 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 127.151 2.181 . . . . 0.0 114.755 177.858 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 11.6 m-85 -75.67 -15.76 60.28 Favored 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 116.733 2.123 . . . . 0.0 116.733 162.294 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 589' ' ' THR . . . . . 0.569 HG22 ' HA ' ' A' ' 527' ' ' ALA . 40.8 p -120.16 174.34 6.56 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 125.495 1.518 . . . . 0.0 109.479 -174.596 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -122.34 139.33 53.95 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 123.871 0.869 . . . . 0.0 109.313 172.192 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.03 116.09 8.28 Favored 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 108.088 -1.079 . . . . 0.0 108.088 176.667 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 592' ' ' VAL . . . . . 0.477 HG23 ' HB2' ' A' ' 524' ' ' LYS . 4.6 m . . . . . 0 N--CA 1.474 0.757 0 C-N-CA 124.623 1.169 . . . . 0.0 108.062 175.743 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo . . . . . 0 CA--C 1.536 0.615 0 CA-C-O 121.134 0.389 . . . . 0.0 112.397 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 5.9 t -125.57 129.64 72.75 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.858 0 C-N-CA 124.777 1.231 . . . . 0.0 112.41 -176.624 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -69.34 141.52 91.24 Favored Pre-proline 0 CA--C 1.548 0.896 0 O-C-N 121.818 -0.551 . . . . 0.0 112.163 -177.112 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 3.6 Cg_endo -66.1 162.32 36.12 Favored 'Trans proline' 0 CA--C 1.541 0.864 0 C-N-CA 122.541 2.161 . . . . 0.0 112.596 172.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo . . . . . 0 CA--C 1.54 0.788 0 C-N-CA 123.195 2.597 . . . . 0.0 112.809 163.435 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 517' ' ' LEU . . . . . 0.454 HD22 HD22 ' A' ' 548' ' ' LEU . 13.8 mt . . . . . 0 CA--C 1.546 0.797 0 N-CA-C 111.88 0.326 . . . . 0.0 111.88 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_endo -66.97 159.55 51.39 Favored 'Trans proline' 0 CA--C 1.544 0.99 0 C-N-CA 124.242 3.295 . . . . 0.0 113.932 -172.725 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_endo -61.13 121.72 10.08 Favored 'Trans proline' 0 CA--C 1.536 0.594 0 C-N-CA 123.707 2.938 . . . . 0.0 112.121 -173.298 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 77.54 4.22 84.31 Favored Glycine 0 CA--C 1.536 1.348 0 CA-C-O 117.081 -1.955 . . . . 0.0 116.27 -178.674 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 15.4 t80 -28.17 130.94 0.05 Allowed 'General case' 0 CA--C 1.547 0.851 0 N-CA-C 118.434 2.753 . . . . 0.0 118.434 178.008 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 48.5 mtm -99.41 -53.85 3.11 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 113.283 0.845 . . . . 0.0 113.283 -177.178 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 523' ' ' PHE . . . . . . . . . . . . . 17.8 p90 -166.52 165.96 16.54 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 126.439 1.896 . . . . 0.0 112.942 -172.683 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 524' ' ' LYS . . . . . 0.538 ' HE2' ' CD2' ' A' ' 548' ' ' LEU . 74.0 mttt -98.39 162.48 13.14 Favored 'General case' 0 CA--C 1.539 0.522 0 O-C-N 121.194 -0.942 . . . . 0.0 111.545 165.813 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 19.8 m -135.6 159.54 40.01 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 C-N-CA 126.546 1.938 . . . . 0.0 109.259 167.12 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 30.5 tt0 -122.04 126.86 49.43 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 124.052 0.941 . . . . 0.0 111.441 174.633 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 527' ' ' ALA . . . . . 0.485 ' HA ' HG22 ' A' ' 589' ' ' THR . . . -61.51 124.28 20.2 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 123.975 0.91 . . . . 0.0 111.629 179.253 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 38.8 mm-40 -87.38 -18.98 28.8 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 125.825 1.65 . . . . 0.0 112.232 176.751 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 97.0 m-70 -148.37 169.12 20.87 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 128.468 2.707 . . . . 0.0 109.84 -177.507 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -83.16 144.55 29.75 Favored 'General case' 0 CA--C 1.539 0.528 0 O-C-N 121.117 -0.989 . . . . 0.0 108.937 172.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 84.3 t80 -134.63 117.25 15.9 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 124.679 1.192 . . . . 0.0 113.234 173.489 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -86.95 116.08 24.77 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 114.335 1.235 . . . . 0.0 114.335 174.486 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -66.25 137.79 57.21 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 123.376 0.67 . . . . 0.0 112.013 177.615 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 13.4 t -112.43 -26.91 8.48 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 125.573 1.549 . . . . 0.0 114.012 175.807 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 27.4 t0 -93.64 149.98 20.79 Favored 'General case' 0 N--CA 1.473 0.721 0 O-C-N 120.857 -1.152 . . . . 0.0 108.323 175.069 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 536' ' ' THR . . . . . . . . . . . . 0.255 0.6 OUTLIER -59.2 -19.56 46.42 Favored 'General case' 0 N--CA 1.469 0.488 0 N-CA-C 115.998 1.851 . . . . 0.0 115.998 165.188 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 38.8 m-20 -82.19 -15.62 52.57 Favored 'General case' 0 CA--C 1.542 0.663 0 N-CA-C 117.625 2.454 . . . . 0.0 117.625 168.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 61.0 mt-10 -86.06 145.43 27.07 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 114.541 1.311 . . . . 0.0 114.541 -172.713 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -87.93 136.1 33.11 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 126.476 1.91 . . . . 0.0 110.415 174.369 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 38.9 tt0 -94.53 129.81 41.18 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 125.176 1.39 . . . . 0.0 110.83 177.478 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 81.4 mt -124.85 154.02 41.68 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 125.112 1.365 . . . . 0.0 112.146 -178.316 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 6.3 tmtm? -126.48 144.27 50.91 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 125.873 1.669 . . . . 0.0 108.223 168.739 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -47.84 117.74 2.0 Favored 'General case' 0 CA--C 1.543 0.709 0 CA-C-O 122.422 1.105 . . . . 0.0 112.267 177.598 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 103.96 -5.14 46.11 Favored Glycine 0 CA--C 1.529 0.968 0 C-N-CA 127.179 2.323 . . . . 0.0 113.577 178.287 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 75.4 m-20 -73.71 127.68 33.45 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 118.945 1.372 . . . . 0.0 114.436 -173.603 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 2.0 t -76.98 135.18 27.15 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 N-CA-C 112.473 0.546 . . . . 0.0 112.473 173.897 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 1.2 t -126.48 122.88 62.08 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 C-N-CA 125.199 1.4 . . . . 0.0 111.81 177.272 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 548' ' ' LEU . . . . . 0.538 ' CD2' ' HE2' ' A' ' 524' ' ' LYS . 17.5 mt -78.03 99.61 6.17 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 124.488 1.115 . . . . 0.0 108.636 174.56 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 549' ' ' VAL . . . . . . . . . . . . . 4.6 t -62.5 128.61 24.57 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.032 0 N-CA-C 113.666 0.987 . . . . 0.0 113.666 171.497 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 10.9 pt -119.45 153.68 53.94 Favored Pre-proline 0 N--CA 1.47 0.552 0 C-N-CA 126.138 1.775 . . . . 0.0 109.817 179.877 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 77.4 Cg_endo -67.11 142.73 62.48 Favored 'Trans proline' 0 N--CA 1.458 -0.596 0 C-N-CA 122.823 2.349 . . . . 0.0 110.443 175.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 552' ' ' PHE . . . . . 0.427 ' CE1' ' HA ' ' A' ' 558' ' ' GLN . 39.1 m-85 . . . . . 0 CA--C 1.53 0.179 0 N-CA-C 117.288 2.329 . . . . 0.0 117.288 -177.087 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 558' ' ' GLN . . . . . 0.427 ' HA ' ' CE1' ' A' ' 552' ' ' PHE . 7.0 tt0 . . . . . 0 N--CA 1.465 0.317 0 CA-C-O 122.035 0.921 . . . . 0.0 112.683 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . 0.296 9.1 m-20 -96.67 138.92 33.51 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 116.744 2.128 . . . . 0.0 116.744 172.775 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 17.3 tp10 -68.05 124.62 23.92 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.695 1.198 . . . . 0.0 111.007 -177.73 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 83.51 -2.99 86.42 Favored Glycine 0 CA--C 1.535 1.341 0 C-N-CA 125.134 1.349 . . . . 0.0 115.173 -171.409 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 50.2 m95 -98.93 161.3 13.7 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 125.312 1.445 . . . . 0.0 112.348 172.891 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 13.1 mt -137.31 154.94 49.98 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 124.688 1.195 . . . . 0.0 110.213 172.263 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 56.5 ttm -116.23 141.14 48.53 Favored 'General case' 0 N--CA 1.464 0.229 0 C-N-CA 124.717 1.207 . . . . 0.0 111.537 178.172 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -173.1 -171.87 38.16 Favored Glycine 0 CA--C 1.522 0.5 0 C-N-CA 123.341 0.496 . . . . 0.0 113.028 -179.836 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 13.2 p -133.17 140.97 45.9 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.634 0 C-N-CA 125.76 1.624 . . . . 0.0 108.916 171.943 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 35.4 mtmt -58.48 137.85 57.08 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 121.284 -0.885 . . . . 0.0 111.16 176.35 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -60.36 -41.76 94.39 Favored 'General case' 0 C--O 1.22 -0.45 0 CA-C-O 118.9 -0.571 . . . . 0.0 110.707 174.661 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 32.1 t -67.91 -20.18 65.07 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 119.151 0.887 . . . . 0.0 113.062 177.24 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 33.8 m-20 -78.57 -44.92 22.99 Favored 'General case' 0 CA--C 1.541 0.63 0 O-C-N 120.642 -1.287 . . . . 0.0 114.351 168.554 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 66.0 t-105 -72.63 -33.84 66.91 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 125.907 1.683 . . . . 0.0 113.618 177.898 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 44.3 t-20 -71.79 -21.64 61.69 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 127.063 2.145 . . . . 0.0 111.848 172.628 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 75.4 mt-30 -91.2 1.19 57.28 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.972 1.309 . . . . 0.0 113.544 164.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 93.4 m-70 59.68 28.75 18.24 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 126.782 2.033 . . . . 0.0 114.854 170.484 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 75.0 mttt -68.34 163.28 23.42 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 126.144 1.778 . . . . 0.0 111.855 179.245 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 4.8 pm0 -54.72 111.44 0.81 Allowed 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 113.653 0.983 . . . . 0.0 113.653 -175.143 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 50.5 tp -64.0 -34.71 78.63 Favored 'General case' 0 N--CA 1.469 0.504 0 O-C-N 120.659 -1.276 . . . . 0.0 111.223 -169.444 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 32.5 mp0 -72.86 -17.55 61.52 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 125.545 1.538 . . . . 0.0 113.737 -174.415 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 50.1 mmtt -118.91 -25.09 6.37 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 125.334 1.454 . . . . 0.0 114.256 179.223 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 98.0 m -71.32 -33.0 69.27 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 118.526 0.603 . . . . 0.0 112.128 169.211 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 15.1 ptp180 -63.25 165.14 7.77 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-O 121.888 0.851 . . . . 0.0 112.886 173.761 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -178.12 178.63 48.56 Favored Glycine 0 CA--C 1.523 0.531 0 CA-C-N 115.034 -0.985 . . . . 0.0 112.593 171.799 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 27.5 m -93.66 141.48 14.73 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.461 0 C-N-CA 123.758 0.823 . . . . 0.0 110.697 167.293 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 43.8 p90 -134.04 154.48 80.24 Favored Pre-proline 0 C--O 1.24 0.563 0 C-N-CA 124.997 1.319 . . . . 0.0 112.371 175.415 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -68.44 112.48 2.83 Favored 'Trans proline' 0 N--CA 1.459 -0.53 0 C-N-CA 121.86 1.707 . . . . 0.0 109.214 172.398 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 19.5 pt-20 -56.87 -26.98 59.82 Favored 'General case' 0 N--CA 1.476 0.844 0 O-C-N 121.252 -0.905 . . . . 0.0 112.428 -176.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 6.7 p-10 -64.81 -23.73 67.33 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 125.782 1.633 . . . . 0.0 113.594 177.023 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 23.0 m-85 -69.86 -11.63 61.01 Favored 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 117.074 2.25 . . . . 0.0 117.074 166.577 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 589' ' ' THR . . . . . 0.485 HG22 ' HA ' ' A' ' 527' ' ' ALA . 71.5 p -128.53 174.59 9.24 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 125.603 1.561 . . . . 0.0 110.546 -176.391 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -134.37 145.81 49.32 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 123.612 0.765 . . . . 0.0 110.711 169.596 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -58.83 135.14 57.42 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 124.959 1.303 . . . . 0.0 110.804 175.542 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 592' ' ' VAL . . . . . 0.484 HG23 ' HB2' ' A' ' 524' ' ' LYS . 3.1 m . . . . . 0 CA--C 1.544 0.745 0 C-N-CA 126.013 1.725 . . . . 0.0 107.762 173.851 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo . . . . . 0 CA--C 1.54 0.798 0 CA-C-O 122.219 0.841 . . . . 0.0 113.511 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 7.1 t -134.26 129.54 53.49 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 C-N-CA 125.796 1.638 . . . . 0.0 112.123 -176.53 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -69.55 133.79 88.78 Favored Pre-proline 0 CA--C 1.555 1.161 0 O-C-N 121.558 -0.714 . . . . 0.0 112.596 -177.04 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -80.05 164.06 22.55 Favored 'Trans proline' 0 CA--C 1.547 1.161 0 C-N-CA 123.274 2.649 . . . . 0.0 113.353 -177.888 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 77.1 Cg_exo . . . . . 0 CA--C 1.54 0.79 0 C-N-CA 123.716 2.944 . . . . 0.0 114.907 -178.764 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 517' ' ' LEU . . . . . 0.448 HD22 HD22 ' A' ' 548' ' ' LEU . 10.3 mt . . . . . 0 CA--C 1.55 0.972 0 N-CA-C 111.966 0.358 . . . . 0.0 111.966 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -73.15 160.51 45.24 Favored 'Trans proline' 0 CA--C 1.539 0.757 0 C-N-CA 123.677 2.918 . . . . 0.0 113.394 -174.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -62.81 135.0 49.66 Favored 'Trans proline' 0 N--CA 1.459 -0.547 0 C-N-CA 123.353 2.702 . . . . 0.0 110.228 178.867 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 76.82 -1.34 62.93 Favored Glycine 0 CA--C 1.534 1.254 0 CA-C-O 117.295 -1.836 . . . . 0.0 115.508 -178.139 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 49.0 t80 -41.29 131.69 2.73 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 120.683 2.241 . . . . 0.0 115.741 -177.317 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 65.6 mtm -105.52 -56.27 2.2 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 123.269 0.628 . . . . 0.0 111.595 179.547 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 523' ' ' PHE . . . . . . . . . . . . . 21.9 p90 -161.33 168.24 24.31 Favored 'General case' 0 C--O 1.224 -0.239 0 C-N-CA 125.88 1.672 . . . . 0.0 113.35 -173.417 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 524' ' ' LYS . . . . . 0.545 ' HE2' ' CD2' ' A' ' 548' ' ' LEU . 41.9 mttt -98.44 163.58 12.63 Favored 'General case' 0 N--CA 1.469 0.506 0 O-C-N 121.223 -0.923 . . . . 0.0 112.155 165.371 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 13.7 m -133.91 158.48 42.41 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 C-N-CA 126.706 2.002 . . . . 0.0 109.171 164.228 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 54.8 tt0 -122.0 131.57 54.07 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 119.12 0.873 . . . . 0.0 112.034 170.701 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 527' ' ' ALA . . . . . 0.449 ' HA ' HG22 ' A' ' 589' ' ' THR . . . -64.15 125.38 24.34 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 121.115 -0.991 . . . . 0.0 112.68 179.166 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 58.8 mm-40 -89.54 -23.94 21.88 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 125.791 1.636 . . . . 0.0 112.024 174.04 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 96.6 m-70 -141.28 162.53 35.27 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 126.768 2.027 . . . . 0.0 110.699 -175.323 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -80.67 128.1 33.24 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 125.68 1.592 . . . . 0.0 113.825 176.782 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 86.2 t80 -129.27 115.67 17.97 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.521 1.129 . . . . 0.0 113.933 179.18 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -79.36 121.84 25.63 Favored 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 116.139 1.904 . . . . 0.0 116.139 175.365 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -71.33 124.49 24.67 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 118.723 0.692 . . . . 0.0 111.455 175.533 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 9.8 t -129.41 37.93 3.94 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 127.095 2.158 . . . . 0.0 110.089 -177.399 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 18.6 t0 -161.78 158.2 25.35 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.804 1.642 . . . . 0.0 107.67 166.211 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 3.1 t -62.73 -21.32 65.71 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 114.982 1.475 . . . . 0.0 114.982 164.539 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 29.0 t0 -74.95 -30.07 61.12 Favored 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 125.343 1.457 . . . . 0.0 110.364 173.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 67.7 mt-10 -84.64 154.74 22.35 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 115.515 1.672 . . . . 0.0 115.515 -164.872 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -102.88 134.04 46.96 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 127.449 2.3 . . . . 0.0 110.217 174.118 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 29.5 tt0 -87.63 128.72 35.27 Favored 'General case' 0 CA--C 1.537 0.457 0 O-C-N 121.483 -0.761 . . . . 0.0 110.965 174.661 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 78.2 mt -120.82 146.76 46.2 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 123.971 0.908 . . . . 0.0 111.088 178.53 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 7.3 tmtm? -121.86 144.94 48.54 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 125.447 1.499 . . . . 0.0 108.693 170.47 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -55.24 109.81 0.59 Allowed 'General case' 0 CA--C 1.548 0.871 0 CA-C-O 121.601 0.715 . . . . 0.0 111.622 -177.74 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 118.1 -11.13 13.24 Favored Glycine 0 CA--C 1.534 1.242 0 C-N-CA 126.857 2.17 . . . . 0.0 114.652 -175.539 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 85.9 m-20 -70.38 120.17 15.64 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 119.604 1.702 . . . . 0.0 114.017 -173.795 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 1.8 t -72.39 135.6 27.45 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.088 0 CA-C-N 119.051 0.841 . . . . 0.0 112.547 167.22 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 1.1 t -126.93 122.49 60.49 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.455 0 C-N-CA 126.236 1.814 . . . . 0.0 111.708 177.635 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 548' ' ' LEU . . . . . 0.545 ' CD2' ' HE2' ' A' ' 524' ' ' LYS . 19.1 mt -77.92 101.45 6.84 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 124.845 1.258 . . . . 0.0 108.787 174.548 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 549' ' ' VAL . . . . . . . . . . . . . 5.0 t -63.6 131.42 29.16 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.076 0 N-CA-C 114.252 1.204 . . . . 0.0 114.252 173.497 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 3.8 pt -130.51 154.53 81.65 Favored Pre-proline 0 CA--C 1.547 0.854 0 C-N-CA 127.027 2.131 . . . . 0.0 109.318 177.3 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo -71.9 143.85 41.92 Favored 'Trans proline' 0 CA--C 1.536 0.62 0 C-N-CA 123.442 2.762 . . . . 0.0 110.989 174.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 19.3 m-85 . . . . . 0 N--CA 1.466 0.344 0 N-CA-C 117.739 2.496 . . . . 0.0 117.739 -170.604 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 38.3 tt0 . . . . . 0 CA--C 1.536 0.427 0 N-CA-C 112.685 0.624 . . . . 0.0 112.685 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -101.06 144.92 29.4 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 124.673 1.189 . . . . 0.0 108.496 -173.583 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 43.0 tp10 -73.64 124.36 25.8 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.407 1.083 . . . . 0.0 111.787 -174.694 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 82.01 2.07 90.47 Favored Glycine 0 CA--C 1.54 1.646 0 C-N-CA 124.374 0.987 . . . . 0.0 115.273 -175.844 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 45.2 m95 -97.9 165.98 11.67 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 126.132 1.773 . . . . 0.0 113.427 176.3 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 14.7 mt -133.46 161.28 34.98 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 124.702 1.201 . . . . 0.0 110.654 168.239 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 50.6 ttm -119.29 144.51 46.76 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 125.362 1.465 . . . . 0.0 111.52 176.21 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -173.68 -173.43 39.88 Favored Glycine 0 CA--C 1.527 0.801 0 C-N-CA 124.275 0.941 . . . . 0.0 113.399 177.384 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 13.9 p -130.92 141.73 45.42 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 C-N-CA 126.265 1.826 . . . . 0.0 108.907 172.76 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 26.7 mtmt -61.35 139.44 58.18 Favored 'General case' 0 N--CA 1.468 0.459 0 O-C-N 120.867 -1.146 . . . . 0.0 111.771 177.9 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 20.8 tt0 -61.77 -42.31 98.82 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-O 118.288 -0.863 . . . . 0.0 111.17 178.639 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 24.6 t -65.43 -30.55 71.36 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-N 119.36 0.982 . . . . 0.0 112.61 177.041 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 89.0 m-20 -67.28 -43.58 81.41 Favored 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 114.555 1.317 . . . . 0.0 114.555 171.691 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 64.3 t-105 -71.91 -26.69 62.41 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.885 1.274 . . . . 0.0 113.285 172.694 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 7.3 t-20 -74.47 -31.15 62.13 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.862 1.665 . . . . 0.0 111.093 171.792 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 64.5 mm-40 -77.41 -7.08 55.57 Favored 'General case' 0 N--CA 1.477 0.894 0 CA-C-N 119.09 0.859 . . . . 0.0 113.23 166.799 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 12.1 m-70 63.24 32.09 15.1 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 127.284 2.234 . . . . 0.0 112.728 178.335 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 28.6 mttm -63.27 157.29 23.15 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 125.073 1.349 . . . . 0.0 112.649 179.53 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 3.9 pm0 -52.81 101.19 0.04 OUTLIER 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 124.865 1.266 . . . . 0.0 113.055 -179.448 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 26.4 tp -59.08 -47.95 83.39 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 124.165 0.986 . . . . 0.0 111.351 -163.428 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 21.0 mp0 -73.17 -18.55 61.25 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 115.461 -0.791 . . . . 0.0 112.098 -168.377 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 57.3 tptt -95.56 -36.02 11.43 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 124.69 1.196 . . . . 0.0 112.92 170.022 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 6.3 t -77.9 -22.27 49.95 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 124.112 0.965 . . . . 0.0 112.901 -174.164 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 32.0 ptt180 -64.26 163.11 13.42 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.802 1.241 . . . . 0.0 112.327 171.94 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -170.56 173.65 44.43 Favored Glycine 0 CA--C 1.526 0.769 0 C-N-CA 123.874 0.749 . . . . 0.0 113.95 175.654 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 19.5 m -91.55 144.16 9.78 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 C-N-CA 124.641 1.176 . . . . 0.0 112.064 170.704 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 47.5 p90 -140.9 153.74 67.8 Favored Pre-proline 0 CA--C 1.543 0.684 0 C-N-CA 124.782 1.233 . . . . 0.0 113.202 177.094 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -65.79 112.16 2.13 Favored 'Trans proline' 0 C--N 1.347 0.484 0 C-N-CA 122.195 1.93 . . . . 0.0 109.543 169.906 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 21.9 pt-20 -54.37 -31.14 54.0 Favored 'General case' 0 N--CA 1.473 0.721 0 O-C-N 121.735 -0.603 . . . . 0.0 112.243 -178.388 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 9.7 p-10 -68.46 -17.36 64.17 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 126.642 1.977 . . . . 0.0 114.318 -179.86 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 19.4 m-85 -72.13 -11.08 60.58 Favored 'General case' 0 CA--C 1.534 0.365 0 N-CA-C 116.269 1.951 . . . . 0.0 116.269 164.369 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 589' ' ' THR . . . . . 0.449 HG22 ' HA ' ' A' ' 527' ' ' ALA . 71.5 p -129.85 166.42 20.0 Favored 'General case' 0 C--O 1.234 0.237 0 C-N-CA 125.809 1.644 . . . . 0.0 112.037 -173.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -122.93 134.34 54.36 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 123.547 0.739 . . . . 0.0 110.377 176.941 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.84 123.93 21.92 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 125.808 1.643 . . . . 0.0 109.555 -177.548 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 592' ' ' VAL . . . . . . . . . . . . . 6.9 m . . . . . 0 CA--C 1.552 1.034 0 C-N-CA 124.854 1.262 . . . . 0.0 109.306 -177.211 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 70.5 Cg_endo . . . . . 0 CA--C 1.543 0.931 0 CA-C-O 121.844 0.685 . . . . 0.0 113.405 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 15.6 t -124.75 137.88 55.96 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 C-N-CA 125.159 1.384 . . . . 0.0 111.924 175.476 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -68.44 143.27 95.28 Favored Pre-proline 0 CA--C 1.554 1.112 0 O-C-N 121.537 -0.727 . . . . 0.0 112.631 179.086 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 26.6 Cg_endo -76.87 164.52 29.84 Favored 'Trans proline' 0 CA--C 1.548 1.2 0 C-N-CA 122.893 2.395 . . . . 0.0 113.51 177.221 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo . . . . . 0 CA--C 1.541 0.849 0 C-N-CA 123.455 2.77 . . . . 0.0 112.131 176.44 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 517' ' ' LEU . . . . . 0.474 HD22 HD22 ' A' ' 548' ' ' LEU . 11.7 mt . . . . . 0 CA--C 1.553 1.093 0 CA-C-O 120.196 0.046 . . . . 0.0 111.069 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -67.97 160.07 50.15 Favored 'Trans proline' 0 CA--C 1.541 0.842 0 C-N-CA 123.671 2.914 . . . . 0.0 113.222 -177.078 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -62.61 134.15 46.12 Favored 'Trans proline' 0 CA--C 1.535 0.562 0 C-N-CA 123.05 2.5 . . . . 0.0 111.037 -177.598 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 74.42 -2.1 47.7 Favored Glycine 0 CA--C 1.535 1.337 0 CA-C-O 117.628 -1.651 . . . . 0.0 115.751 -178.675 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 31.3 t80 -31.69 123.7 0.27 Allowed 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 117.827 2.528 . . . . 0.0 117.827 -176.795 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 46.2 mtm -94.81 -53.1 3.98 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 112.413 0.523 . . . . 0.0 112.413 -176.095 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 523' ' ' PHE . . . . . 0.402 ' CE2' HG21 ' A' ' 549' ' ' VAL . 28.1 p90 -169.55 174.26 5.99 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 126.556 1.943 . . . . 0.0 112.872 -173.591 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 524' ' ' LYS . . . . . 0.451 ' HG2' HD23 ' A' ' 548' ' ' LEU . 50.9 mttt -106.58 163.81 12.58 Favored 'General case' 0 N--CA 1.47 0.543 0 O-C-N 120.818 -1.176 . . . . 0.0 112.653 169.207 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 12.5 m -133.3 160.91 42.16 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.925 0 C-N-CA 126.626 1.97 . . . . 0.0 110.065 165.413 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 25.6 tt0 -124.5 127.37 47.35 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 119.709 1.14 . . . . 0.0 112.919 172.733 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 527' ' ' ALA . . . . . 0.492 ' HA ' HG22 ' A' ' 589' ' ' THR . . . -64.6 123.71 19.98 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.618 1.167 . . . . 0.0 112.738 -178.45 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 35.5 mm-40 -89.68 -25.35 21.27 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 125.426 1.49 . . . . 0.0 111.87 175.276 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 94.3 m-70 -138.62 164.66 28.91 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 127.745 2.418 . . . . 0.0 110.121 179.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -87.73 138.64 31.29 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 107.092 -1.447 . . . . 0.0 107.092 177.098 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 66.9 t80 -127.43 115.74 19.38 Favored 'General case' 0 C--N 1.332 -0.187 0 C-N-CA 125.586 1.555 . . . . 0.0 113.648 -179.194 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -84.15 128.45 34.57 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 114.722 1.379 . . . . 0.0 114.722 -177.56 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -72.11 108.64 5.41 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 121.778 0.799 . . . . 0.0 111.139 -179.309 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 12.3 t -80.53 -17.97 49.91 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 114.388 1.255 . . . . 0.0 114.388 -177.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 24.8 m-20 -148.57 168.84 21.71 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 127.205 2.202 . . . . 0.0 114.9 -171.262 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 2.0 t -61.06 -34.78 75.43 Favored 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 117.012 2.227 . . . . 0.0 117.012 -173.284 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 45.3 m-20 -81.34 -15.21 56.04 Favored 'General case' 0 CA--C 1.539 0.558 0 N-CA-C 114.971 1.471 . . . . 0.0 114.971 177.643 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 24.3 mp0 -83.71 134.37 34.76 Favored 'General case' 0 CA--C 1.543 0.707 0 O-C-N 120.873 -1.142 . . . . 0.0 113.849 -166.412 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -83.9 128.63 34.68 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.922 1.689 . . . . 0.0 110.442 178.93 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 8.6 tt0 -90.1 132.41 35.44 Favored 'General case' 0 CA--C 1.537 0.48 0 O-C-N 121.667 -0.645 . . . . 0.0 111.932 177.827 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 73.1 mt -123.68 146.43 48.24 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.722 1.209 . . . . 0.0 112.643 -174.741 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -114.3 141.17 47.93 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 125.05 1.34 . . . . 0.0 110.126 170.272 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -56.2 104.91 0.16 Allowed 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 123.75 0.82 . . . . 0.0 111.895 179.622 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 125.38 -12.74 7.48 Favored Glycine 0 CA--C 1.532 1.147 0 C-N-CA 126.616 2.055 . . . . 0.0 114.296 -174.161 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 90.0 m-20 -74.14 125.43 28.33 Favored 'General case' 0 C--O 1.231 0.12 0 N-CA-C 115.227 1.565 . . . . 0.0 115.227 -173.183 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 2.6 t -73.85 134.33 29.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 C-N-CA 122.921 0.488 . . . . 0.0 111.394 167.041 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 1.4 t -121.92 121.6 64.59 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.593 0 C-N-CA 124.9 1.28 . . . . 0.0 111.308 174.108 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 548' ' ' LEU . . . . . 0.474 HD22 HD22 ' A' ' 517' ' ' LEU . 18.3 mt -77.17 100.22 5.7 Favored 'General case' 0 CA--C 1.539 0.525 0 N-CA-C 108.055 -1.091 . . . . 0.0 108.055 175.895 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 549' ' ' VAL . . . . . 0.402 HG21 ' CE2' ' A' ' 523' ' ' PHE . 4.1 t -62.03 129.31 24.96 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.92 0 N-CA-C 113.652 0.982 . . . . 0.0 113.652 171.572 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 8.3 pt -123.69 154.67 66.9 Favored Pre-proline 0 CA--C 1.54 0.592 0 C-N-CA 125.965 1.706 . . . . 0.0 109.447 179.581 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -65.39 142.28 71.71 Favored 'Trans proline' 0 N--CA 1.458 -0.593 0 C-N-CA 122.711 2.274 . . . . 0.0 110.026 174.686 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 34.5 m-85 . . . . . 0 C--O 1.235 0.335 0 N-CA-C 116.807 2.151 . . . . 0.0 116.807 -175.555 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 49.1 tt0 . . . . . 0 CA--C 1.538 0.497 0 N-CA-C 111.988 0.366 . . . . 0.0 111.988 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -114.73 149.77 36.34 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 126.189 1.795 . . . . 0.0 113.083 171.517 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 57.0 tt0 -69.9 122.99 20.37 Favored 'General case' 0 CA--C 1.538 0.49 0 O-C-N 121.142 -0.974 . . . . 0.0 111.436 -173.493 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 85.43 -2.23 88.13 Favored Glycine 0 CA--C 1.535 1.343 0 C-N-CA 125.059 1.314 . . . . 0.0 115.059 -176.519 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 59.1 m95 -95.08 154.1 17.34 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 126.025 1.73 . . . . 0.0 112.643 174.008 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 13.1 mt -131.04 159.73 36.68 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 123.18 0.592 . . . . 0.0 111.161 168.967 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 48.3 ttm -117.27 139.55 50.67 Favored 'General case' 0 CA--C 1.527 0.091 0 C-N-CA 125.384 1.474 . . . . 0.0 110.712 -179.668 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -170.37 -175.75 39.39 Favored Glycine 0 CA--C 1.523 0.584 0 C-N-CA 123.943 0.783 . . . . 0.0 112.49 -178.896 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 14.9 p -128.04 138.82 53.61 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.444 0 C-N-CA 125.406 1.482 . . . . 0.0 108.578 169.526 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 38.7 mtmt -58.09 134.43 56.43 Favored 'General case' 0 N--CA 1.465 0.307 0 O-C-N 121.377 -0.827 . . . . 0.0 110.559 176.198 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -58.92 -42.99 91.0 Favored 'General case' 0 C--O 1.22 -0.469 0 CA-C-O 118.773 -0.632 . . . . 0.0 109.749 175.552 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 57.4 p -60.0 -22.59 62.77 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 115.508 1.67 . . . . 0.0 115.508 174.074 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 53.9 m-20 -85.13 -45.31 12.19 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.962 1.305 . . . . 0.0 114.219 173.862 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 59.4 t-105 -67.57 -35.86 79.84 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.323 1.449 . . . . 0.0 112.826 174.857 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 9.7 t-20 -77.7 -14.44 59.61 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 126.21 1.804 . . . . 0.0 112.852 175.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 57.4 mm-40 -90.81 0.46 57.45 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 125.198 1.399 . . . . 0.0 112.666 162.106 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 93.6 m-70 59.58 34.85 22.46 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 127.871 2.468 . . . . 0.0 114.044 175.894 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 6.6 mtpm? -74.45 147.78 41.68 Favored 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 125.217 1.407 . . . . 0.0 110.659 177.806 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 6.7 pm0 -51.94 103.58 0.07 Allowed 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 126.585 1.954 . . . . 0.0 114.505 -175.397 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 57.5 tp -51.38 -49.63 61.14 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 126.236 1.814 . . . . 0.0 113.27 -171.713 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 92.6 mt-10 -66.02 -13.43 59.91 Favored 'General case' 0 CA--C 1.546 0.805 0 N-CA-C 114.154 1.168 . . . . 0.0 114.154 -175.757 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 33.5 mmtp -106.7 -30.13 9.16 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 125.381 1.472 . . . . 0.0 112.963 171.818 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 84.0 m -82.9 -23.04 33.75 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 114.221 1.193 . . . . 0.0 114.221 -176.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 40.3 ptt180 -63.64 162.61 12.77 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.907 1.283 . . . . 0.0 112.753 173.287 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -175.43 176.21 47.31 Favored Glycine 0 CA--C 1.529 0.929 0 CA-C-N 115.282 -0.872 . . . . 0.0 115.132 170.525 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 34.1 m -93.36 140.88 15.61 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 C-N-CA 124.819 1.247 . . . . 0.0 112.242 169.482 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 50.8 p90 -140.37 155.92 69.88 Favored Pre-proline 0 CA--C 1.544 0.721 0 C-N-CA 125.259 1.423 . . . . 0.0 112.484 176.738 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_endo -71.11 112.37 3.29 Favored 'Trans proline' 0 CA--C 1.533 0.467 0 C-N-CA 122.535 2.157 . . . . 0.0 109.667 171.158 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 20.2 pt-20 -57.56 -26.06 60.88 Favored 'General case' 0 N--CA 1.476 0.871 0 O-C-N 121.286 -0.884 . . . . 0.0 112.441 179.906 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 10.1 p-10 -71.75 -10.72 60.19 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 125.683 1.593 . . . . 0.0 114.859 177.268 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 18.6 m-85 -75.65 -13.83 60.34 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 117.003 2.223 . . . . 0.0 117.003 160.051 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 589' ' ' THR . . . . . 0.492 HG22 ' HA ' ' A' ' 527' ' ' ALA . 73.4 p -122.13 175.8 6.17 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 126.339 1.856 . . . . 0.0 110.477 -175.91 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -124.59 137.78 54.37 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 124.145 0.978 . . . . 0.0 108.803 170.003 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.67 125.56 27.78 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 123.742 0.817 . . . . 0.0 109.151 179.666 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 592' ' ' VAL . . . . . . . . . . . . . 7.1 m . . . . . 0 N--CA 1.479 1.022 0 C-N-CA 124.911 1.284 . . . . 0.0 109.774 -175.586 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo . . . . . 0 CA--C 1.54 0.8 0 CA-C-O 121.551 0.563 . . . . 0.0 112.784 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 4.1 t -135.44 135.14 51.97 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 C-N-CA 124.978 1.311 . . . . 0.0 112.83 178.631 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -61.62 136.63 94.69 Favored Pre-proline 0 CA--C 1.554 1.127 0 O-C-N 121.636 -0.665 . . . . 0.0 112.253 178.321 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -71.52 168.08 24.58 Favored 'Trans proline' 0 CA--C 1.543 0.972 0 C-N-CA 123.305 2.67 . . . . 0.0 111.586 171.712 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo . . . . . 0 CA--C 1.542 0.889 0 C-N-CA 122.739 2.293 . . . . 0.0 113.211 -179.564 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 517' ' ' LEU . . . . . 0.418 HD22 HD22 ' A' ' 548' ' ' LEU . 10.5 mt . . . . . 0 CA--C 1.551 0.99 0 N-CA-C 111.945 0.35 . . . . 0.0 111.945 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -69.27 161.35 46.24 Favored 'Trans proline' 0 CA--C 1.537 0.648 0 C-N-CA 124.02 3.146 . . . . 0.0 113.782 -175.643 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 65.8 Cg_endo -61.87 142.06 92.04 Favored 'Trans proline' 0 N--CA 1.458 -0.569 0 C-N-CA 122.732 2.288 . . . . 0.0 110.283 178.139 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 67.37 3.56 26.03 Favored Glycine 0 CA--C 1.533 1.186 0 CA-C-O 117.198 -1.89 . . . . 0.0 116.177 -178.369 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 27.9 t80 -40.56 137.28 1.15 Allowed 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 116.886 2.18 . . . . 0.0 116.886 -178.119 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 57.1 mtm -112.91 -53.87 2.67 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 113.435 0.902 . . . . 0.0 113.435 -174.748 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 523' ' ' PHE . . . . . 0.481 ' CE1' HG21 ' A' ' 549' ' ' VAL . 26.1 p90 -167.36 174.32 8.12 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 126.612 1.965 . . . . 0.0 111.389 -178.205 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 524' ' ' LYS . . . . . 0.483 ' HE2' ' CD2' ' A' ' 548' ' ' LEU . 78.1 mttt -109.41 161.95 14.82 Favored 'General case' 0 N--CA 1.467 0.414 0 O-C-N 121.413 -0.804 . . . . 0.0 111.226 171.759 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 5.6 m -130.23 163.83 34.74 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 C-N-CA 126.261 1.824 . . . . 0.0 110.202 165.411 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 60.8 tt0 -129.52 130.81 46.26 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 118.836 0.744 . . . . 0.0 112.694 169.586 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 527' ' ' ALA . . . . . 0.529 ' HA ' HG22 ' A' ' 589' ' ' THR . . . -64.07 119.14 9.58 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.604 1.162 . . . . 0.0 112.335 -178.06 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 46.9 mm-40 -86.13 -22.23 27.18 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.229 1.411 . . . . 0.0 111.417 171.762 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 89.1 m-70 -140.87 157.69 45.02 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 126.404 1.882 . . . . 0.0 110.455 178.033 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -84.77 141.79 30.27 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 -178.656 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 76.9 t80 -136.45 120.7 17.91 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 125.895 1.678 . . . . 0.0 112.306 -179.532 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 1.9 m -90.37 132.78 35.4 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 114.01 1.115 . . . . 0.0 114.01 175.233 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -67.36 128.45 36.44 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-O 121.588 0.709 . . . . 0.0 112.186 -176.655 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 1.7 p -107.19 -3.64 19.62 Favored 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 116.743 2.127 . . . . 0.0 116.743 -177.647 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 34.9 t0 -143.87 165.78 26.77 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 124.799 1.24 . . . . 0.0 108.984 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 1.5 t -55.83 -35.51 66.46 Favored 'General case' 0 N--CA 1.464 0.271 0 N-CA-C 114.673 1.36 . . . . 0.0 114.673 167.081 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 90.2 m-20 -68.06 -22.71 64.93 Favored 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 117.093 2.257 . . . . 0.0 117.093 176.25 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -88.2 144.8 26.24 Favored 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 115.398 1.629 . . . . 0.0 115.398 -163.137 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -90.28 139.89 30.22 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 127.326 2.25 . . . . 0.0 109.82 177.552 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 15.9 tt0 -91.63 131.13 37.25 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.801 0.84 . . . . 0.0 110.559 171.393 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 80.5 mt -124.89 136.94 54.25 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 124.998 1.319 . . . . 0.0 111.961 -179.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 3.3 tppp? -96.27 141.72 29.27 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 125.873 1.669 . . . . 0.0 110.495 163.614 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -57.25 107.73 0.45 Allowed 'General case' 0 CA--C 1.545 0.752 0 CA-C-N 119.281 0.946 . . . . 0.0 109.907 170.163 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 122.46 -11.06 9.11 Favored Glycine 0 CA--C 1.537 1.437 0 C-N-CA 126.546 2.022 . . . . 0.0 114.592 -172.191 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 74.6 m-20 -71.85 124.86 25.75 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 119.835 1.818 . . . . 0.0 115.72 -178.029 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 16.7 t -74.89 133.25 31.88 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 C-N-CA 123.232 0.613 . . . . 0.0 110.369 164.382 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -125.48 122.15 61.92 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.443 0 C-N-CA 125.011 1.324 . . . . 0.0 111.136 175.84 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 548' ' ' LEU . . . . . 0.483 ' CD2' ' HE2' ' A' ' 524' ' ' LYS . 20.8 mt -79.93 103.45 9.82 Favored 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 108.149 -1.056 . . . . 0.0 108.149 177.643 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 549' ' ' VAL . . . . . 0.481 HG21 ' CE1' ' A' ' 523' ' ' PHE . 4.0 t -62.32 126.32 20.33 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.083 0 N-CA-C 113.499 0.926 . . . . 0.0 113.499 172.204 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 20.5 pt -126.43 159.8 61.23 Favored Pre-proline 0 N--CA 1.474 0.744 0 C-N-CA 126.978 2.111 . . . . 0.0 108.94 179.219 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo -72.54 149.74 50.14 Favored 'Trans proline' 0 N--CA 1.456 -0.711 0 C-N-CA 122.948 2.432 . . . . 0.0 112.303 175.362 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 72.0 m-85 . . . . . 0 CA--C 1.533 0.313 0 N-CA-C 113.526 0.936 . . . . 0.0 113.526 167.775 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 54.6 tt0 . . . . . 0 CA--C 1.533 0.31 0 N-CA-C 112.62 0.6 . . . . 0.0 112.62 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 72.5 m-20 -103.99 145.72 29.74 Favored 'General case' 0 CA--C 1.554 1.135 0 C-N-CA 125.684 1.594 . . . . 0.0 113.066 -176.937 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 72.5 tt0 -76.87 107.53 9.26 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 124.786 1.234 . . . . 0.0 112.938 -169.406 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 96.11 1.29 61.27 Favored Glycine 0 CA--C 1.537 1.419 0 C-N-CA 125.072 1.32 . . . . 0.0 114.392 -174.745 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 53.5 m95 -93.53 169.48 10.31 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 126.344 1.857 . . . . 0.0 113.31 176.67 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 16.6 mt -141.38 153.22 44.95 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 125.488 1.515 . . . . 0.0 110.39 165.787 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 57.5 ttm -105.25 142.52 34.87 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 125.396 1.479 . . . . 0.0 112.262 170.575 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -165.24 -174.83 35.31 Favored Glycine 0 CA--C 1.527 0.788 0 C-N-CA 124.946 1.26 . . . . 0.0 112.795 174.566 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 12.7 p -128.92 139.99 50.43 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 C-N-CA 125.127 1.371 . . . . 0.0 109.321 169.777 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 34.9 mtmt -58.02 135.59 56.99 Favored 'General case' 0 N--CA 1.468 0.435 0 O-C-N 121.538 -0.726 . . . . 0.0 110.814 175.407 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -59.22 -38.88 81.05 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-O 118.159 -0.924 . . . . 0.0 111.215 176.768 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 8.7 t -71.77 -32.65 67.9 Favored 'General case' 0 N--CA 1.477 0.89 0 CA-C-N 119.912 1.233 . . . . 0.0 111.782 -179.175 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 71.2 m-20 -61.59 -50.19 73.62 Favored 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 113.669 0.989 . . . . 0.0 113.669 167.751 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 49.8 t-105 -68.04 -33.36 74.42 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 114.305 1.224 . . . . 0.0 114.305 -179.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 8.4 t-20 -68.17 -30.16 69.2 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.591 1.157 . . . . 0.0 111.919 178.292 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 41.6 mt-30 -78.3 3.47 15.42 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.489 1.116 . . . . 0.0 112.984 170.764 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 26.0 m-70 61.15 31.46 19.63 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 126.538 1.935 . . . . 0.0 112.897 179.573 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 20.9 mttm -65.11 154.7 37.15 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 123.883 0.873 . . . . 0.0 112.807 179.819 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 9.1 pm0 -53.18 104.74 0.1 Allowed 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 126.152 1.781 . . . . 0.0 112.892 179.573 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 58.2 tp -64.02 -50.08 69.85 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 124.488 1.115 . . . . 0.0 111.917 -166.299 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 16.1 pm0 -61.39 -22.8 65.31 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.285 1.034 . . . . 0.0 113.778 -178.149 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 23.4 tptm -88.46 -55.27 3.79 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 126.062 1.745 . . . . 0.0 111.195 175.124 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 87.8 m -75.0 -19.63 60.0 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 125.155 1.382 . . . . 0.0 114.694 -168.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 19.9 ptt180 -64.03 160.47 17.94 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 123.649 0.78 . . . . 0.0 111.61 170.202 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -166.21 172.33 41.5 Favored Glycine 0 CA--C 1.525 0.709 0 CA-C-N 115.142 -0.936 . . . . 0.0 113.158 173.302 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 22.7 m -91.61 145.53 7.39 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.34 0 C-N-CA 124.427 1.091 . . . . 0.0 111.245 168.853 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 47.4 p90 -140.57 155.5 69.63 Favored Pre-proline 0 C--O 1.24 0.6 0 C-N-CA 124.82 1.248 . . . . 0.0 112.664 176.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -67.95 109.41 1.92 Allowed 'Trans proline' 0 N--CA 1.457 -0.623 0 C-N-CA 122.0 1.8 . . . . 0.0 109.62 170.503 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 19.2 pt-20 -54.47 -28.02 41.68 Favored 'General case' 0 N--CA 1.476 0.844 0 O-C-N 121.215 -0.928 . . . . 0.0 112.386 -179.627 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 11.6 p-10 -69.07 -13.59 62.53 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 126.143 1.777 . . . . 0.0 114.361 177.554 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 15.0 m-85 -74.39 -12.83 60.62 Favored 'General case' 0 N--CA 1.467 0.382 0 N-CA-C 116.802 2.149 . . . . 0.0 116.802 163.561 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 589' ' ' THR . . . . . 0.529 HG22 ' HA ' ' A' ' 527' ' ' ALA . 73.4 p -123.99 173.99 7.88 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 125.404 1.482 . . . . 0.0 111.679 -172.93 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -119.89 140.99 50.0 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.746 1.218 . . . . 0.0 108.942 169.726 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 15.0 tpt180 -67.44 105.72 1.9 Allowed 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.496 1.119 . . . . 0.0 108.959 171.545 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 592' ' ' VAL . . . . . 0.445 HG23 ' HB2' ' A' ' 524' ' ' LYS . 2.1 m . . . . . 0 CA--C 1.541 0.633 0 C-N-CA 123.637 0.775 . . . . 0.0 109.275 178.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo . . . . . 0 CA--C 1.542 0.912 0 N-CA-C 114.039 0.746 . . . . 0.0 114.039 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 29.7 t -133.85 131.51 56.35 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 125.63 1.572 . . . . 0.0 111.429 -179.622 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -65.62 139.47 97.11 Favored Pre-proline 0 CA--C 1.552 1.039 0 O-C-N 121.439 -0.788 . . . . 0.0 112.361 -179.047 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo -75.13 164.94 32.15 Favored 'Trans proline' 0 CA--C 1.547 1.152 0 C-N-CA 123.186 2.59 . . . . 0.0 112.62 175.709 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo . . . . . 0 CA--C 1.541 0.86 0 C-N-CA 123.67 2.913 . . . . 0.0 114.223 174.888 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 517' ' ' LEU . . . . . 0.517 HD22 HD22 ' A' ' 548' ' ' LEU . 14.1 mt . . . . . 0 CA--C 1.545 0.77 0 N-CA-C 111.818 0.303 . . . . 0.0 111.818 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -68.45 159.26 54.18 Favored 'Trans proline' 0 CA--C 1.539 0.771 0 C-N-CA 123.957 3.105 . . . . 0.0 113.38 -172.734 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -61.89 128.42 24.24 Favored 'Trans proline' 0 N--CA 1.459 -0.536 0 C-N-CA 123.218 2.612 . . . . 0.0 111.321 -174.759 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 73.48 5.47 67.85 Favored Glycine 0 CA--C 1.537 1.446 0 CA-C-O 116.865 -2.075 . . . . 0.0 115.805 -177.177 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 22.2 t80 -35.67 133.96 0.37 Allowed 'General case' 0 N--CA 1.471 0.608 0 CA-C-N 120.508 2.154 . . . . 0.0 116.52 177.254 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 53.3 mtm -107.08 -57.45 2.07 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 123.541 0.736 . . . . 0.0 111.701 -177.301 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 523' ' ' PHE . . . . . . . . . . . . . 25.8 p90 -160.25 169.66 22.75 Favored 'General case' 0 C--O 1.222 -0.366 0 C-N-CA 125.168 1.387 . . . . 0.0 114.142 -174.571 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 524' ' ' LYS . . . . . 0.547 ' HG2' HD23 ' A' ' 548' ' ' LEU . 85.3 mttt -102.6 164.19 11.79 Favored 'General case' 0 CA--C 1.538 0.485 0 O-C-N 121.118 -0.989 . . . . 0.0 112.272 168.056 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 10.2 m -136.32 159.49 38.34 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 C-N-CA 127.051 2.14 . . . . 0.0 109.546 165.109 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 45.0 tt0 -123.58 128.57 49.89 Favored 'General case' 0 N--CA 1.475 0.779 0 CA-C-N 119.323 0.965 . . . . 0.0 112.213 168.755 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 527' ' ' ALA . . . . . 0.493 ' HA ' HG22 ' A' ' 589' ' ' THR . . . -64.03 122.61 16.95 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.103 0.961 . . . . 0.0 112.313 -179.275 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 48.5 mm-40 -88.23 -23.18 23.61 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.497 1.519 . . . . 0.0 111.867 174.514 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 93.8 m-70 -139.65 157.74 45.27 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 126.984 2.114 . . . . 0.0 110.206 -175.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 34.8 p-10 -87.19 135.65 33.22 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 119.374 0.988 . . . . 0.0 113.22 -179.503 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 83.0 t80 -128.63 110.03 11.87 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 124.6 1.16 . . . . 0.0 111.829 -178.332 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 532' ' ' THR . . . . . . . . . . . . 0.253 0.2 OUTLIER -82.91 113.91 20.84 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 114.148 1.166 . . . . 0.0 114.148 168.677 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -62.02 143.73 56.16 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 123.858 0.863 . . . . 0.0 112.186 175.43 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 534' ' ' THR . . . . . . . . . . . . 0.27 4.6 t -126.23 21.96 7.27 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 127.233 2.213 . . . . 0.0 114.36 179.496 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 38.7 t0 -152.63 156.24 38.88 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 107.565 -1.272 . . . . 0.0 107.565 165.764 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 5.0 t -68.17 -10.39 53.92 Favored 'General case' 0 N--CA 1.476 0.86 0 N-CA-C 114.956 1.465 . . . . 0.0 114.956 167.33 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 39.7 t0 -77.55 -31.03 53.02 Favored 'General case' 0 CA--C 1.553 1.07 0 C-N-CA 125.506 1.523 . . . . 0.0 110.989 167.037 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 82.8 mt-10 -81.52 147.16 29.81 Favored 'General case' 0 CA--C 1.547 0.835 0 O-C-N 120.265 -1.522 . . . . 0.0 113.67 -175.779 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -93.14 139.04 31.01 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 127.068 2.147 . . . . 0.0 110.31 176.027 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 15.6 tt0 -94.72 129.91 41.44 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.408 1.083 . . . . 0.0 111.574 179.423 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 76.7 mt -128.56 148.7 50.78 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.699 1.2 . . . . 0.0 112.86 -176.023 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 12.5 tmtt? -120.41 148.13 44.17 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 126.32 1.848 . . . . 0.0 109.841 169.766 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -56.29 99.5 0.03 OUTLIER 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 123.735 0.814 . . . . 0.0 111.856 174.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 127.73 -4.59 7.03 Favored Glycine 0 CA--C 1.537 1.456 0 C-N-CA 126.659 2.076 . . . . 0.0 114.304 -176.282 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 81.6 m-20 -79.33 120.88 24.4 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 119.395 1.597 . . . . 0.0 113.648 -176.018 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 36.6 t -74.49 135.01 28.33 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 CA-C-N 119.138 0.881 . . . . 0.0 110.15 168.695 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -123.1 122.21 64.96 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.508 0 C-N-CA 125.651 1.58 . . . . 0.0 111.496 174.549 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 548' ' ' LEU . . . . . 0.547 HD23 ' HG2' ' A' ' 524' ' ' LYS . 42.4 mt -78.44 101.2 7.18 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.457 1.103 . . . . 0.0 108.318 175.279 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 549' ' ' VAL . . . . . . . . . . . . . 4.4 t -63.97 131.49 29.62 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.337 0 N-CA-C 114.844 1.424 . . . . 0.0 114.844 173.313 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 15.8 pt -131.93 154.76 81.84 Favored Pre-proline 0 CA--C 1.548 0.903 0 C-N-CA 126.383 1.873 . . . . 0.0 111.28 -178.78 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -72.81 149.18 47.56 Favored 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 124.321 3.347 . . . . 0.0 111.785 173.597 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 63.6 m-85 . . . . . 0 CA--C 1.539 0.543 0 N-CA-C 114.897 1.443 . . . . 0.0 114.897 -178.656 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 39.9 tt0 . . . . . 0 CA--C 1.537 0.469 0 N-CA-C 114.152 1.167 . . . . 0.0 114.152 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 54.5 m-20 -93.36 150.25 20.61 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 126.183 1.793 . . . . 0.0 111.726 174.677 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 30.7 tp10 -80.8 127.99 33.15 Favored 'General case' 0 N--CA 1.474 0.726 0 O-C-N 120.968 -1.083 . . . . 0.0 110.895 -177.334 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 83.88 4.9 88.4 Favored Glycine 0 CA--C 1.538 1.501 0 O-C-N 121.327 -0.858 . . . . 0.0 114.705 -173.153 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 562' ' ' TRP . . . . . 0.411 ' CZ2' ' HB1' ' B' 1733 ' ' ALA . 50.2 m95 -110.74 157.38 19.83 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 127.019 2.128 . . . . 0.0 112.598 178.401 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 11.5 mt -133.15 153.74 51.25 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 123.286 0.634 . . . . 0.0 110.992 173.564 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 41.9 ttm -106.37 142.76 35.51 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 123.997 0.919 . . . . 0.0 112.136 177.123 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -165.25 -170.34 30.07 Favored Glycine 0 CA--C 1.525 0.697 0 C-N-CA 124.282 0.944 . . . . 0.0 112.309 173.69 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 14.3 p -134.41 140.7 45.34 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.502 0 C-N-CA 125.966 1.707 . . . . 0.0 108.993 170.884 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 41.7 mtmt -62.42 134.76 56.89 Favored 'General case' 0 N--CA 1.465 0.304 0 O-C-N 121.139 -0.976 . . . . 0.0 112.064 176.636 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -57.36 -43.06 83.2 Favored 'General case' 0 C--O 1.222 -0.375 0 CA-C-O 118.12 -0.943 . . . . 0.0 111.391 -177.006 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 33.2 t -62.62 -33.1 74.32 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 119.358 0.981 . . . . 0.0 113.529 -178.849 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -69.69 -45.95 67.12 Favored 'General case' 0 CA--C 1.542 0.672 0 O-C-N 120.835 -1.166 . . . . 0.0 108.812 176.19 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 66.1 t-105 -66.72 -36.3 82.16 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 124.329 1.052 . . . . 0.0 112.525 179.49 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -67.78 -31.27 71.04 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 126.288 1.835 . . . . 0.0 111.783 175.213 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 44.1 mt-30 -77.09 -0.63 25.48 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.609 1.164 . . . . 0.0 113.73 172.287 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 67.0 m-70 68.37 18.85 9.05 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 127.99 2.516 . . . . 0.0 115.119 -178.406 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 6.7 mtpm? -76.34 160.71 29.35 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 125.233 1.413 . . . . 0.0 112.987 -173.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 18.1 pm0 -58.72 127.29 31.43 Favored 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 114.189 1.181 . . . . 0.0 114.189 -175.059 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 62.0 tp -75.31 -45.81 37.3 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 125.405 1.482 . . . . 0.0 111.891 -173.622 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 23.9 pt-20 -62.81 -18.33 62.61 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 113.856 1.058 . . . . 0.0 113.856 -174.506 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 4.2 tppp? -95.07 -41.57 9.05 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 126.065 1.746 . . . . 0.0 113.715 176.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 48.3 t -78.25 -28.18 47.7 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 118.568 0.622 . . . . 0.0 112.479 -179.796 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 50.7 ptt85 -54.08 149.47 9.35 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-O 121.74 0.781 . . . . 0.0 112.382 -179.74 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -172.47 170.73 43.77 Favored Glycine 0 N--CA 1.462 0.427 0 CA-C-N 115.358 -0.837 . . . . 0.0 114.348 177.025 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 17.6 m -91.91 136.78 23.59 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.252 0 C-N-CA 124.782 1.233 . . . . 0.0 111.43 171.854 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 44.6 p90 -132.57 154.79 81.65 Favored Pre-proline 0 CA--C 1.539 0.536 0 C-N-CA 124.358 1.063 . . . . 0.0 112.968 175.711 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -68.46 110.78 2.36 Favored 'Trans proline' 0 N--CA 1.457 -0.655 0 C-N-CA 122.262 1.975 . . . . 0.0 110.02 169.702 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 21.3 pt-20 -55.79 -29.49 59.77 Favored 'General case' 0 CA--C 1.547 0.855 0 O-C-N 121.416 -0.802 . . . . 0.0 112.233 -179.832 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 9.7 p-10 -67.22 -8.7 33.55 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 126.141 1.776 . . . . 0.0 114.523 179.446 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 17.1 m-85 -82.68 -11.9 58.0 Favored 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 116.783 2.142 . . . . 0.0 116.783 166.622 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 589' ' ' THR . . . . . 0.493 HG22 ' HA ' ' A' ' 527' ' ' ALA . 60.4 p -122.77 173.23 7.88 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 125.511 1.525 . . . . 0.0 111.528 -171.881 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -124.14 139.45 53.91 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.061 0.945 . . . . 0.0 108.997 170.13 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.82 136.23 57.25 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 125.149 1.379 . . . . 0.0 109.127 177.225 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 592' ' ' VAL . . . . . 0.524 HG23 ' HB2' ' A' ' 524' ' ' LYS . 2.4 m . . . . . 0 N--CA 1.481 1.115 0 C-N-CA 124.78 1.232 . . . . 0.0 109.486 177.783 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo . . . . . 0 CA--C 1.542 0.879 0 CA-C-O 121.095 0.373 . . . . 0.0 112.966 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 2.9 t -132.49 138.86 51.24 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 C-N-CA 125.777 1.631 . . . . 0.0 112.96 178.869 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B 1733 ' ' ALA . . . . . 0.411 ' HB1' ' CZ2' ' A' ' 562' ' ' TRP . . . -72.63 139.7 80.99 Favored Pre-proline 0 CA--C 1.555 1.135 0 O-C-N 120.763 -1.211 . . . . 0.0 112.759 -176.558 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo -76.23 165.45 29.45 Favored 'Trans proline' 0 CA--C 1.553 1.428 0 C-N-CA 123.049 2.5 . . . . 0.0 114.181 -177.442 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 34.5 Cg_exo . . . . . 0 C--N 1.351 0.703 0 C-N-CA 123.999 3.133 . . . . 0.0 114.207 179.723 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 517' ' ' LEU . . . . . 0.52 HD22 HD22 ' A' ' 548' ' ' LEU . 14.9 mt . . . . . 0 CA--C 1.551 0.992 0 N-CA-C 112.605 0.595 . . . . 0.0 112.605 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_endo -67.8 162.14 40.86 Favored 'Trans proline' 0 CA--C 1.539 0.775 0 C-N-CA 123.755 2.97 . . . . 0.0 114.055 -176.056 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -64.11 138.67 63.0 Favored 'Trans proline' 0 C--N 1.348 0.546 0 C-N-CA 122.78 2.32 . . . . 0.0 109.89 176.348 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 70.58 4.72 53.69 Favored Glycine 0 CA--C 1.532 1.114 0 CA-C-O 117.638 -1.646 . . . . 0.0 115.69 -176.016 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 48.8 t80 -44.72 129.87 7.03 Favored 'General case' 0 C--O 1.238 0.494 0 CA-C-N 120.82 2.31 . . . . 0.0 115.216 179.697 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 60.1 mtm -105.36 -59.09 1.81 Allowed 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 123.883 0.873 . . . . 0.0 111.932 -179.151 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 523' ' ' PHE . . . . . 0.573 ' CD1' ' HD3' ' A' ' 591' ' ' ARG . 32.5 p90 -160.34 175.45 12.82 Favored 'General case' 0 C--O 1.224 -0.252 0 C-N-CA 126.155 1.782 . . . . 0.0 112.406 -175.555 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 524' ' ' LYS . . . . . 0.517 ' HG2' HD23 ' A' ' 548' ' ' LEU . 81.3 mttt -106.51 164.09 12.34 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 121.023 -1.048 . . . . 0.0 112.65 171.332 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 12.0 m -131.62 160.94 42.02 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 C-N-CA 126.145 1.778 . . . . 0.0 109.552 164.377 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 45.2 tt0 -122.19 128.03 50.72 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 118.613 0.642 . . . . 0.0 111.423 166.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 527' ' ' ALA . . . . . 0.402 ' HA ' HG22 ' A' ' 589' ' ' THR . . . -56.63 123.35 14.55 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.241 1.016 . . . . 0.0 111.209 173.049 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 42.3 mm-40 -84.84 -27.45 26.74 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.153 1.381 . . . . 0.0 110.91 168.596 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 88.0 m-70 -139.34 160.18 40.43 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 127.065 2.146 . . . . 0.0 111.657 -174.23 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . 0.314 1.6 p30 -84.19 138.2 33.11 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 115.713 1.746 . . . . 0.0 115.713 178.932 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 89.3 t80 -138.25 128.33 25.69 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.609 1.564 . . . . 0.0 114.298 -176.147 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -90.8 128.2 36.62 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 124.7 1.2 . . . . 0.0 114.189 175.03 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -69.99 121.78 18.07 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 119.161 0.891 . . . . 0.0 110.822 173.032 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 12.2 t -88.51 -20.55 24.97 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 115.049 1.5 . . . . 0.0 115.049 -177.766 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 18.8 m-20 -145.18 177.5 8.75 Favored 'General case' 0 CA--C 1.554 1.11 0 N-CA-C 116.872 2.175 . . . . 0.0 116.872 -165.856 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 5.3 t -59.37 -17.81 33.28 Favored 'General case' 0 N--CA 1.481 1.09 0 N-CA-C 119.141 3.015 . . . . 0.0 119.141 -173.67 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . 0.287 18.8 m-20 -129.14 16.73 6.14 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 125.9 1.68 . . . . 0.0 115.18 175.776 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 20.0 mp0 -95.67 145.0 25.61 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.947 1.299 . . . . 0.0 112.797 -174.985 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -99.61 128.72 45.72 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 125.194 1.398 . . . . 0.0 111.538 -172.979 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 38.0 tt0 -84.64 124.95 32.04 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 124.843 1.257 . . . . 0.0 110.396 176.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 79.9 mt -125.12 145.99 49.68 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 124.925 1.29 . . . . 0.0 112.275 -178.933 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -115.11 143.73 44.75 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 125.817 1.647 . . . . 0.0 109.367 168.829 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -55.72 110.12 0.67 Allowed 'General case' 0 CA--C 1.545 0.777 0 CA-C-N 118.503 0.592 . . . . 0.0 110.705 179.736 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 115.78 -5.58 20.54 Favored Glycine 0 CA--C 1.538 1.488 0 C-N-CA 126.415 1.96 . . . . 0.0 114.618 -174.796 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 83.2 m-20 -72.82 124.64 25.79 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 115.794 1.775 . . . . 0.0 115.794 -176.906 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 41.7 t -72.84 133.71 31.22 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 C-N-CA 123.68 0.792 . . . . 0.0 110.156 169.116 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 1.5 t -128.07 123.66 60.99 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.328 0 C-N-CA 124.57 1.148 . . . . 0.0 111.527 174.301 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 548' ' ' LEU . . . . . 0.52 HD22 HD22 ' A' ' 517' ' ' LEU . 30.1 mt -79.98 100.47 8.14 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.004 1.322 . . . . 0.0 108.55 177.465 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 549' ' ' VAL . . . . . 0.41 HG21 ' CE1' ' A' ' 523' ' ' PHE . 7.1 t -61.1 132.14 26.46 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.267 0 N-CA-C 114.924 1.453 . . . . 0.0 114.924 173.928 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 20.9 pt -129.99 157.45 76.9 Favored Pre-proline 0 CA--C 1.551 0.981 0 C-N-CA 127.098 2.159 . . . . 0.0 109.873 174.924 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -73.66 154.69 49.56 Favored 'Trans proline' 0 CA--C 1.536 0.601 0 C-N-CA 124.021 3.147 . . . . 0.0 112.094 174.911 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 36.8 m-85 . . . . . 0 CA--C 1.541 0.605 0 N-CA-C 117.195 2.294 . . . . 0.0 117.195 176.395 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 . . . . . 0 N--CA 1.467 0.386 0 N-CA-C 113.375 0.88 . . . . 0.0 113.375 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . 0.292 18.5 m-20 -96.6 140.03 31.81 Favored 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 116.554 2.057 . . . . 0.0 116.554 -179.175 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 54.9 tp10 -73.88 120.81 19.98 Favored 'General case' 0 CA--C 1.539 0.537 0 O-C-N 120.955 -1.091 . . . . 0.0 112.078 -173.563 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 87.82 3.12 80.63 Favored Glycine 0 CA--C 1.536 1.36 0 C-N-CA 124.514 1.054 . . . . 0.0 114.599 -172.68 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 57.1 m95 -100.98 164.52 11.78 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.569 1.548 . . . . 0.0 112.919 176.284 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 11.6 mt -137.77 152.4 49.13 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 124.943 1.297 . . . . 0.0 109.831 168.699 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 52.1 ttm -108.1 141.97 39.0 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 124.306 1.042 . . . . 0.0 111.503 172.516 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -169.85 -171.79 35.74 Favored Glycine 0 CA--C 1.526 0.767 0 C-N-CA 124.543 1.068 . . . . 0.0 112.666 176.188 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 14.7 p -132.65 138.54 51.79 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 C-N-CA 125.66 1.584 . . . . 0.0 108.893 171.085 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 37.9 mtmt -59.09 139.42 56.89 Favored 'General case' 0 N--CA 1.467 0.42 0 O-C-N 121.224 -0.922 . . . . 0.0 111.167 176.052 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 14.1 tt0 -60.0 -43.19 95.37 Favored 'General case' 0 C--O 1.222 -0.379 0 CA-C-O 119.008 -0.52 . . . . 0.0 110.742 176.524 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 76.4 p -60.05 -34.62 73.66 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 114.403 1.26 . . . . 0.0 114.403 176.467 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 40.9 m-20 -71.15 -45.84 62.71 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.281 1.432 . . . . 0.0 113.893 173.719 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 56.6 t-105 -71.46 -34.79 70.54 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 125.065 1.346 . . . . 0.0 113.834 178.332 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 33.6 t-20 -67.61 -21.81 65.39 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 125.586 1.554 . . . . 0.0 111.881 176.747 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 23.6 mm-40 -89.02 6.51 39.36 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.816 1.246 . . . . 0.0 114.279 169.411 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 2.2 m-70 61.92 23.57 13.89 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 125.79 1.636 . . . . 0.0 113.938 171.66 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 19.2 mtpp -74.56 168.48 19.68 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 125.931 1.693 . . . . 0.0 113.016 -175.774 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 8.3 pm0 -56.72 97.66 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.974 1.71 . . . . 0.0 113.327 -176.632 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 60.6 tp -54.23 -43.26 70.7 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.328 1.451 . . . . 0.0 111.906 -173.807 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -63.01 -33.85 76.31 Favored 'General case' 0 N--CA 1.476 0.859 0 N-CA-C 113.131 0.789 . . . . 0.0 113.131 -176.743 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 29.6 mmtp -88.49 -39.05 14.49 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 123.673 0.789 . . . . 0.0 112.511 175.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 93.6 m -71.83 -35.09 69.79 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 113.274 0.842 . . . . 0.0 113.274 -177.176 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.13 169.98 1.83 Allowed 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.174 0.99 . . . . 0.0 112.07 176.918 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -178.78 177.56 48.49 Favored Glycine 0 N--CA 1.45 -0.399 0 CA-C-N 114.606 -1.179 . . . . 0.0 114.414 166.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 19.3 m -88.88 141.61 14.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 C-N-CA 124.66 1.184 . . . . 0.0 111.542 166.227 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 39.8 p90 -136.5 154.06 76.55 Favored Pre-proline 0 CA--C 1.538 0.518 0 C-N-CA 125.395 1.478 . . . . 0.0 112.187 175.149 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -65.9 112.45 2.24 Favored 'Trans proline' 0 N--CA 1.46 -0.479 0 C-N-CA 121.788 1.659 . . . . 0.0 108.898 170.134 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 18.7 pt-20 -56.28 -30.8 62.96 Favored 'General case' 0 N--CA 1.471 0.604 0 O-C-N 121.346 -0.846 . . . . 0.0 111.459 -178.015 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 8.4 p-10 -63.49 -18.16 63.51 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 126.081 1.752 . . . . 0.0 113.914 178.667 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 9.5 m-85 -74.39 -13.97 60.8 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 116.125 1.898 . . . . 0.0 116.125 166.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 589' ' ' THR . . . . . 0.402 HG22 ' HA ' ' A' ' 527' ' ' ALA . 30.9 p -121.76 176.67 5.62 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 127.043 2.137 . . . . 0.0 112.199 -176.682 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 15.8 pt-20 -131.69 138.51 48.73 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.757 1.223 . . . . 0.0 109.808 168.476 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 591' ' ' ARG . . . . . 0.573 ' HD3' ' CD1' ' A' ' 523' ' ' PHE . 4.0 tpt180 -66.1 120.82 13.85 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 125.304 1.442 . . . . 0.0 111.294 176.252 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 592' ' ' VAL . . . . . 0.443 HG23 ' HB2' ' A' ' 524' ' ' LYS . 3.8 m . . . . . 0 N--CA 1.477 0.915 0 C-N-CA 125.241 1.416 . . . . 0.0 109.328 -178.154 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo . . . . . 0 CA--C 1.54 0.804 0 CA-C-O 121.493 0.539 . . . . 0.0 112.713 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 31.6 t -129.78 132.38 65.94 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 C-N-CA 125.73 1.612 . . . . 0.0 110.697 176.745 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -67.4 144.97 98.31 Favored Pre-proline 0 CA--C 1.549 0.939 0 N-CA-C 113.077 0.769 . . . . 0.0 113.077 -172.69 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -77.99 168.66 21.72 Favored 'Trans proline' 0 CA--C 1.548 1.183 0 C-N-CA 122.949 2.433 . . . . 0.0 112.391 175.35 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 77.8 Cg_exo . . . . . 0 CA--C 1.542 0.906 0 C-N-CA 123.719 2.946 . . . . 0.0 114.357 177.247 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 517' ' ' LEU . . . . . 0.45 HD22 HD22 ' A' ' 548' ' ' LEU . 9.3 mt . . . . . 0 CA--C 1.541 0.632 0 CA-C-O 119.511 -0.281 . . . . 0.0 111.197 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 29.9 Cg_endo -67.89 157.44 61.79 Favored 'Trans proline' 0 CA--C 1.541 0.834 0 C-N-CA 123.362 2.708 . . . . 0.0 113.791 -171.209 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_endo -62.46 127.51 21.06 Favored 'Trans proline' 0 N--CA 1.459 -0.551 0 C-N-CA 123.584 2.856 . . . . 0.0 110.074 179.406 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 76.46 1.92 72.5 Favored Glycine 0 CA--C 1.532 1.155 0 CA-C-O 117.616 -1.658 . . . . 0.0 115.785 -175.711 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 30.1 t80 -36.78 128.28 0.85 Allowed 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 116.912 2.19 . . . . 0.0 116.912 178.013 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 52.3 mtm -100.11 -55.1 2.71 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 123.081 0.552 . . . . 0.0 112.178 -178.489 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 523' ' ' PHE . . . . . . . . . . . . . 24.6 p90 -165.62 170.38 14.27 Favored 'General case' 0 C--O 1.222 -0.345 0 C-N-CA 126.323 1.849 . . . . 0.0 112.654 -172.936 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 524' ' ' LYS . . . . . 0.52 ' HE2' ' CD2' ' A' ' 548' ' ' LEU . 78.5 mttt -102.18 162.9 12.56 Favored 'General case' 0 CA--C 1.538 0.483 0 O-C-N 121.169 -0.957 . . . . 0.0 111.807 169.298 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 17.7 m -136.24 160.98 38.08 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.904 0 C-N-CA 127.21 2.204 . . . . 0.0 108.788 166.19 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 41.3 tt0 -126.23 125.99 43.3 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 119.204 0.911 . . . . 0.0 111.587 175.347 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 527' ' ' ALA . . . . . 0.505 ' HA ' HG22 ' A' ' 589' ' ' THR . . . -58.24 132.84 54.78 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 124.011 0.924 . . . . 0.0 111.391 -179.783 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 84.0 mm-40 -102.46 -23.8 13.89 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 125.941 1.696 . . . . 0.0 112.179 173.201 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 89.9 m-70 -138.13 160.07 40.38 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 126.254 1.822 . . . . 0.0 111.01 -179.05 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -83.1 128.22 34.29 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 125.28 1.432 . . . . 0.0 113.966 -178.912 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 84.9 t80 -130.69 122.65 27.71 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 115.107 1.521 . . . . 0.0 115.107 -176.973 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -95.68 134.77 38.2 Favored 'General case' 0 N--CA 1.48 1.069 0 N-CA-C 115.652 1.723 . . . . 0.0 115.652 174.114 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -74.59 120.51 20.24 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-O 122.12 0.962 . . . . 0.0 112.947 -175.817 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 4.4 t -90.79 6.98 42.05 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 126.836 2.054 . . . . 0.0 115.84 179.894 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -153.23 155.13 36.04 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 129.172 2.989 . . . . 0.0 111.685 -178.61 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 536' ' ' THR . . . . . . . . . . . . 0.264 0.9 OUTLIER -65.38 -25.56 67.62 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 116.124 1.898 . . . . 0.0 116.124 177.16 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 90.2 m-20 -92.74 -8.58 43.39 Favored 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 115.47 1.656 . . . . 0.0 115.47 175.594 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -74.47 146.46 42.77 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.767 1.227 . . . . 0.0 110.909 174.447 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -84.9 159.4 20.34 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 126.398 1.879 . . . . 0.0 110.202 174.637 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 17.8 tt0 -118.84 138.6 52.61 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.454 1.502 . . . . 0.0 110.658 173.844 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 91.3 mt -133.2 141.23 47.98 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 125.082 1.353 . . . . 0.0 111.953 -174.79 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.23 143.28 40.61 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 125.063 1.345 . . . . 0.0 108.507 164.812 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -53.83 117.8 3.46 Favored 'General case' 0 CA--C 1.548 0.894 0 O-C-N 121.633 -0.667 . . . . 0.0 111.94 -179.868 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 110.85 -9.71 29.77 Favored Glycine 0 CA--C 1.532 1.109 0 C-N-CA 126.772 2.13 . . . . 0.0 113.939 -175.347 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 69.0 m-20 -74.83 121.44 21.82 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 118.689 1.245 . . . . 0.0 113.377 -173.881 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 2.7 t -72.31 136.1 26.37 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 O-C-N 121.713 -0.617 . . . . 0.0 112.071 172.393 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -124.08 122.27 63.99 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.6 0 C-N-CA 126.16 1.784 . . . . 0.0 111.428 175.93 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 548' ' ' LEU . . . . . 0.52 ' CD2' ' HE2' ' A' ' 524' ' ' LYS . 20.0 mt -78.37 99.42 6.36 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.637 1.175 . . . . 0.0 108.637 174.983 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 549' ' ' VAL . . . . . . . . . . . . . 6.1 t -60.92 133.12 26.7 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.268 0 N-CA-C 114.583 1.327 . . . . 0.0 114.583 172.984 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 16.8 pt -130.42 156.17 79.95 Favored Pre-proline 0 CA--C 1.55 0.958 0 C-N-CA 126.77 2.028 . . . . 0.0 110.428 177.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 92.3 Cg_endo -72.19 165.55 32.3 Favored 'Trans proline' 0 CA--C 1.536 0.596 0 C-N-CA 124.194 3.263 . . . . 0.0 111.638 173.024 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 66.0 m-85 . . . . . 0 CA--C 1.535 0.389 0 N-CA-C 116.28 1.956 . . . . 0.0 116.28 -177.692 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 4.5 tp60 . . . . . 0 CA--C 1.54 0.579 0 CA-C-O 121.898 0.856 . . . . 0.0 112.072 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -113.33 141.9 46.49 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 128.146 2.578 . . . . 0.0 113.607 171.169 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 82.5 tt0 -64.42 120.34 12.08 Favored 'General case' 0 N--CA 1.478 0.948 0 O-C-N 119.654 -1.904 . . . . 0.0 112.032 -171.168 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 85.13 5.71 85.42 Favored Glycine 0 CA--C 1.539 1.576 0 C-N-CA 124.897 1.237 . . . . 0.0 115.826 -175.42 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 41.1 m95 -94.33 173.21 7.75 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 125.386 1.474 . . . . 0.0 113.86 178.396 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 17.3 mt -139.92 154.34 47.21 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 125.137 1.375 . . . . 0.0 110.618 166.704 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 31.4 tpp -107.34 143.33 35.78 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 125.28 1.432 . . . . 0.0 110.932 168.731 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -169.41 -172.42 36.04 Favored Glycine 0 CA--C 1.526 0.742 0 C-N-CA 124.38 0.991 . . . . 0.0 112.607 174.376 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 12.0 p -134.22 140.41 46.13 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.568 0 C-N-CA 125.569 1.548 . . . . 0.0 109.124 173.586 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 35.9 mtmt -56.39 136.16 53.79 Favored 'General case' 0 N--CA 1.468 0.428 0 O-C-N 121.24 -0.913 . . . . 0.0 111.356 176.347 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 52.3 tt0 -61.57 -42.41 98.8 Favored 'General case' 0 C--O 1.22 -0.449 0 CA-C-O 117.868 -1.063 . . . . 0.0 110.71 176.355 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 40.1 t -58.58 -37.2 75.26 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 119.696 1.135 . . . . 0.0 112.501 174.634 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 73.6 m-20 -63.75 -44.27 94.0 Favored 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 114.771 1.397 . . . . 0.0 114.771 172.516 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 55.3 t-105 -75.35 -29.36 59.91 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 124.941 1.296 . . . . 0.0 113.634 177.953 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 5.6 t-20 -68.44 -33.51 74.34 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 126.638 1.975 . . . . 0.0 110.711 172.873 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 30.5 mm100 -79.06 -3.7 46.54 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 124.636 1.174 . . . . 0.0 113.92 167.945 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 574' ' ' HIS . . . . . . . . . . . . 0.283 86.4 m-70 64.13 31.93 13.0 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 127.605 2.362 . . . . 0.0 115.547 168.65 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 78.2 mttt -66.6 170.87 5.69 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 127.566 2.346 . . . . 0.0 114.108 -178.225 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 21.4 pt-20 -59.95 104.65 0.32 Allowed 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 124.629 1.172 . . . . 0.0 113.031 171.738 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 57.7 tp -55.74 -42.84 75.98 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 124.226 1.01 . . . . 0.0 112.421 -171.204 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 2.8 pt-20 -61.86 -30.48 70.88 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 114.73 1.381 . . . . 0.0 114.73 -176.131 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 28.2 mmmt -97.47 -30.68 12.76 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 123.547 0.739 . . . . 0.0 112.819 -179.677 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 32.8 m -70.27 -40.39 74.36 Favored 'General case' 0 CA--C 1.538 0.492 0 N-CA-C 113.507 0.928 . . . . 0.0 113.507 173.141 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 29.6 ptt85 -64.39 161.81 16.26 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 123.867 0.867 . . . . 0.0 112.781 178.374 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -175.44 173.39 46.21 Favored Glycine 0 CA--C 1.52 0.354 0 CA-C-N 115.4 -0.818 . . . . 0.0 114.032 174.15 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 30.1 m -87.87 143.7 10.74 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.274 0 C-N-CA 123.262 0.625 . . . . 0.0 110.199 171.76 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 45.4 p90 -143.55 156.58 60.02 Favored Pre-proline 0 CA--C 1.541 0.629 0 C-N-CA 124.742 1.217 . . . . 0.0 112.346 176.7 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -69.75 111.21 2.75 Favored 'Trans proline' 0 C--N 1.347 0.49 0 C-N-CA 122.291 1.994 . . . . 0.0 109.903 172.762 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 19.6 pt-20 -55.82 -29.71 60.23 Favored 'General case' 0 N--CA 1.475 0.806 0 O-C-N 121.547 -0.721 . . . . 0.0 112.076 -179.07 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 10.9 p-10 -66.32 -20.97 66.24 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 125.604 1.561 . . . . 0.0 114.001 178.612 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 14.0 m-85 -69.07 -14.46 63.03 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 116.717 2.117 . . . . 0.0 116.717 164.605 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 589' ' ' THR . . . . . 0.505 HG22 ' HA ' ' A' ' 527' ' ' ALA . 63.5 p -122.0 173.43 7.54 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 126.277 1.831 . . . . 0.0 111.097 -176.357 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 15.1 pt-20 -126.55 136.34 52.44 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 124.245 1.018 . . . . 0.0 109.001 173.474 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.41 128.22 35.6 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 124.247 1.019 . . . . 0.0 108.692 178.606 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 592' ' ' VAL . . . . . 0.459 HG23 ' HB2' ' A' ' 524' ' ' LYS . 1.9 m . . . . . 0 CA--C 1.548 0.886 0 C-N-CA 125.624 1.57 . . . . 0.0 107.666 178.019 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 68.5 Cg_endo . . . . . 0 CA--C 1.543 0.974 0 N-CA-C 113.633 0.589 . . . . 0.0 113.633 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 16.0 t -128.74 126.14 64.51 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.126 0 C-N-CA 125.194 1.398 . . . . 0.0 112.495 -177.081 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -65.79 129.12 94.25 Favored Pre-proline 0 CA--C 1.55 0.969 0 O-C-N 121.533 -0.729 . . . . 0.0 111.475 -178.542 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 26.6 Cg_endo -69.42 157.16 62.07 Favored 'Trans proline' 0 CA--C 1.544 0.985 0 C-N-CA 122.165 1.91 . . . . 0.0 112.718 -173.847 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo . . . . . 0 CA--C 1.538 0.682 0 C-N-CA 123.054 2.503 . . . . 0.0 111.944 -174.809 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 517' ' ' LEU . . . . . 0.475 HD22 HD22 ' A' ' 548' ' ' LEU . 14.0 mt . . . . . 0 CA--C 1.543 0.687 0 N-CA-C 113.419 0.896 . . . . 0.0 113.419 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_endo -66.2 159.53 49.29 Favored 'Trans proline' 0 CA--C 1.538 0.708 0 C-N-CA 123.923 3.082 . . . . 0.0 114.241 -174.039 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 96.1 Cg_endo -68.36 130.15 20.56 Favored 'Trans proline' 0 N--CA 1.457 -0.622 0 C-N-CA 123.366 2.71 . . . . 0.0 109.628 -179.742 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 78.84 1.23 83.9 Favored Glycine 0 CA--C 1.537 1.454 0 CA-C-O 116.777 -2.124 . . . . 0.0 115.578 -175.441 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 22.2 t80 -36.42 133.13 0.54 Allowed 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 117.63 2.456 . . . . 0.0 117.63 -179.751 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 31.0 mtm -100.58 -57.78 2.04 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 123.065 0.546 . . . . 0.0 111.949 -177.005 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 523' ' ' PHE . . . . . 0.463 ' CE1' HG21 ' A' ' 549' ' ' VAL . 20.3 p90 -166.68 175.09 8.15 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 126.911 2.084 . . . . 0.0 112.46 -173.233 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 524' ' ' LYS . . . . . 0.498 ' HG2' HD23 ' A' ' 548' ' ' LEU . 66.6 mttt -107.35 162.69 13.68 Favored 'General case' 0 N--CA 1.476 0.867 0 O-C-N 120.169 -1.582 . . . . 0.0 112.178 168.629 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 5.1 m -133.33 162.5 39.68 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 C-N-CA 126.905 2.082 . . . . 0.0 109.768 164.057 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 42.5 tt0 -128.71 130.45 47.15 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-N 118.868 0.758 . . . . 0.0 111.924 169.305 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 527' ' ' ALA . . . . . 0.519 ' HA ' HG22 ' A' ' 589' ' ' THR . . . -60.92 127.36 31.18 Favored 'General case' 0 N--CA 1.466 0.353 0 O-C-N 121.124 -0.985 . . . . 0.0 111.548 -179.677 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 61.6 mm-40 -89.94 -25.45 20.92 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 125.308 1.443 . . . . 0.0 111.973 171.984 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 96.5 m-70 -142.44 163.77 31.94 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 126.974 2.109 . . . . 0.0 110.257 -172.944 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 35.8 m-20 -80.03 137.4 36.8 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 123.845 0.858 . . . . 0.0 111.726 177.474 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 89.2 t80 -134.36 121.3 20.99 Favored 'General case' 0 C--O 1.236 0.358 0 N-CA-C 114.065 1.135 . . . . 0.0 114.065 175.18 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -88.22 117.11 26.9 Favored 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 115.289 1.589 . . . . 0.0 115.289 173.701 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -67.77 123.68 21.2 Favored 'General case' 0 CA--C 1.537 0.468 0 O-C-N 121.898 -0.501 . . . . 0.0 110.902 171.336 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 6.2 t -115.9 -2.04 12.43 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 126.575 1.95 . . . . 0.0 114.242 -177.281 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 39.5 m-20 -113.73 156.56 23.58 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 125.713 1.605 . . . . 0.0 115.108 157.135 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 6.7 t -59.26 -29.09 67.31 Favored 'General case' 0 CA--C 1.545 0.785 0 N-CA-C 114.33 1.234 . . . . 0.0 114.33 170.584 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -70.42 -20.17 62.94 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 116.862 2.171 . . . . 0.0 116.862 169.467 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 82.1 mt-10 -85.05 149.93 25.22 Favored 'General case' 0 CA--C 1.542 0.651 0 O-C-N 120.671 -1.268 . . . . 0.0 113.95 -170.453 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -99.89 127.83 46.03 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 126.531 1.932 . . . . 0.0 110.663 179.134 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 14.1 tt0 -88.11 127.85 35.42 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 123.47 0.708 . . . . 0.0 111.473 -179.517 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 71.1 mt -119.34 140.7 49.91 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 124.58 1.152 . . . . 0.0 111.932 -177.426 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 14.4 tppt? -107.26 138.28 43.75 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 125.883 1.673 . . . . 0.0 109.063 164.649 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -49.57 114.32 1.02 Allowed 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.771 0.829 . . . . 0.0 110.872 175.173 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 107.52 -4.89 34.99 Favored Glycine 0 CA--C 1.534 1.238 0 C-N-CA 126.693 2.092 . . . . 0.0 114.677 -175.607 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 77.0 m-20 -70.0 120.46 15.75 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 119.734 1.767 . . . . 0.0 114.958 176.546 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 27.4 t -70.92 135.23 28.5 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 CA-C-N 118.539 0.609 . . . . 0.0 110.128 166.569 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 1.4 t -126.07 121.59 59.74 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.404 0 C-N-CA 125.547 1.539 . . . . 0.0 110.474 175.375 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 548' ' ' LEU . . . . . 0.498 HD23 ' HG2' ' A' ' 524' ' ' LYS . 30.6 mt -78.93 104.81 9.81 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 107.937 -1.135 . . . . 0.0 107.937 175.627 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 549' ' ' VAL . . . . . 0.463 HG21 ' CE1' ' A' ' 523' ' ' PHE . 30.9 t -61.03 131.71 26.14 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.901 0 CA-C-O 121.942 0.877 . . . . 0.0 113.17 170.743 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 5.6 pt -126.11 157.11 70.79 Favored Pre-proline 0 CA--C 1.542 0.672 0 C-N-CA 126.582 1.953 . . . . 0.0 108.504 175.936 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -66.62 145.89 77.51 Favored 'Trans proline' 0 N--CA 1.458 -0.595 0 C-N-CA 122.905 2.403 . . . . 0.0 110.74 176.147 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 32.8 m-85 . . . . . 0 C--O 1.234 0.28 0 N-CA-C 115.09 1.515 . . . . 0.0 115.09 177.912 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 35.6 tt0 . . . . . 0 CA--C 1.543 0.691 0 N-CA-C 113.37 0.878 . . . . 0.0 113.37 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 66.5 m-20 -95.13 146.6 24.19 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 127.945 2.498 . . . . 0.0 113.277 176.999 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -81.55 133.9 35.44 Favored 'General case' 0 N--CA 1.472 0.664 0 O-C-N 120.364 -1.46 . . . . 0.0 113.349 -173.843 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 76.9 -1.02 64.22 Favored Glycine 0 CA--C 1.538 1.522 0 C-N-CA 124.025 0.822 . . . . 0.0 114.282 -169.841 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 57.9 m95 -97.07 158.71 15.3 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 125.859 1.663 . . . . 0.0 112.056 174.989 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -135.03 156.47 48.98 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 126.993 2.117 . . . . 0.0 109.486 176.884 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 51.5 ttm -119.01 141.28 48.82 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 124.285 1.034 . . . . 0.0 112.004 175.646 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -171.06 -172.08 36.93 Favored Glycine 0 CA--C 1.524 0.625 0 C-N-CA 123.817 0.722 . . . . 0.0 113.267 179.773 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 12.7 p -133.47 139.94 47.89 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 C-N-CA 126.23 1.812 . . . . 0.0 109.189 173.087 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 34.9 mtmt -57.24 136.61 56.49 Favored 'General case' 0 N--CA 1.469 0.479 0 O-C-N 121.086 -1.009 . . . . 0.0 111.308 175.865 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -60.59 -39.43 88.08 Favored 'General case' 0 CA--C 1.539 0.552 0 O-C-N 122.012 -0.43 . . . . 0.0 110.714 174.914 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 34.2 t -71.13 -14.16 62.19 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 113.911 1.078 . . . . 0.0 113.911 176.073 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 72.5 m-20 -83.68 -45.22 13.66 Favored 'General case' 0 CA--C 1.541 0.626 0 O-C-N 120.709 -1.244 . . . . 0.0 113.848 166.465 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 61.4 t-105 -71.39 -37.76 71.55 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.952 1.301 . . . . 0.0 114.293 179.377 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 7.0 t-20 -67.17 -13.8 62.3 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 124.808 1.243 . . . . 0.0 112.027 174.858 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 5.2 mm-40 -91.48 1.58 57.03 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 125.333 1.453 . . . . 0.0 114.395 171.217 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 48.1 m-70 60.11 35.25 21.24 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 125.275 1.43 . . . . 0.0 112.935 177.84 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 26.6 mtpp -91.58 163.19 14.22 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 125.943 1.697 . . . . 0.0 111.983 -175.829 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 10.7 pm0 -56.37 99.6 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 125.37 1.468 . . . . 0.0 114.618 -170.243 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 54.8 tp -56.22 -46.04 79.66 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 124.186 0.994 . . . . 0.0 111.718 -173.631 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 -62.73 -14.44 44.51 Favored 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 115.095 1.517 . . . . 0.0 115.095 -178.847 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 33.8 mmtp -112.48 -35.88 5.42 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.752 1.221 . . . . 0.0 113.321 175.205 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 83.0 m -67.04 -24.12 65.96 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.163 0.985 . . . . 0.0 112.297 175.517 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 17.3 ptt180 -68.49 149.75 48.89 Favored 'General case' 0 N--CA 1.47 0.526 0 N-CA-C 113.348 0.869 . . . . 0.0 113.348 175.057 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -164.44 172.59 40.25 Favored Glycine 0 CA--C 1.528 0.875 0 CA-C-N 114.598 -1.183 . . . . 0.0 113.917 174.255 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 28.4 m -92.31 143.48 11.28 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 C-N-CA 124.906 1.282 . . . . 0.0 112.108 170.339 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 45.8 p90 -138.6 154.56 73.37 Favored Pre-proline 0 CA--C 1.546 0.789 0 C-N-CA 124.786 1.234 . . . . 0.0 113.949 176.282 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -65.78 113.85 2.71 Favored 'Trans proline' 0 C--N 1.35 0.618 0 C-N-CA 122.924 2.416 . . . . 0.0 110.291 169.672 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 20.1 pt-20 -60.08 -26.0 65.84 Favored 'General case' 0 N--CA 1.479 1.002 0 O-C-N 121.493 -0.754 . . . . 0.0 112.203 -175.136 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 11.2 p-10 -71.92 -18.49 62.02 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 126.969 2.108 . . . . 0.0 113.799 -179.576 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 19.7 m-85 -72.23 -12.19 61.06 Favored 'General case' 0 N--CA 1.467 0.395 0 N-CA-C 116.276 1.954 . . . . 0.0 116.276 166.496 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 589' ' ' THR . . . . . 0.519 HG22 ' HA ' ' A' ' 527' ' ' ALA . 69.5 p -128.25 168.39 15.55 Favored 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 125.536 1.534 . . . . 0.0 110.658 -174.354 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 16.3 pt-20 -122.35 137.15 54.95 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 124.124 0.97 . . . . 0.0 109.976 174.798 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 15.3 tpp85 -64.32 131.58 47.69 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 124.706 1.202 . . . . 0.0 109.94 177.619 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 592' ' ' VAL . . . . . 0.435 HG23 ' HB2' ' A' ' 524' ' ' LYS . 2.9 m . . . . . 0 N--CA 1.482 1.13 0 C-N-CA 125.645 1.578 . . . . 0.0 110.232 -177.545 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 98.9 Cg_endo . . . . . 0 CA--C 1.541 0.826 0 CA-C-O 121.67 0.613 . . . . 0.0 113.19 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 6.5 t -128.45 140.37 49.4 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.875 0 C-N-CA 126.153 1.781 . . . . 0.0 111.968 172.141 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -67.16 139.19 95.0 Favored Pre-proline 0 CA--C 1.55 0.965 0 O-C-N 121.518 -0.739 . . . . 0.0 112.835 -178.112 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -75.82 162.99 34.27 Favored 'Trans proline' 0 CA--C 1.543 0.967 0 C-N-CA 122.866 2.377 . . . . 0.0 113.204 -178.823 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 64.5 Cg_endo . . . . . 0 CA--C 1.539 0.772 0 C-N-CA 123.602 2.868 . . . . 0.0 112.408 179.661 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 517' ' ' LEU . . . . . 0.456 HD22 HD22 ' A' ' 548' ' ' LEU . 10.8 mt . . . . . 0 CA--C 1.542 0.642 0 N-CA-C 111.69 0.256 . . . . 0.0 111.69 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -68.25 159.09 54.74 Favored 'Trans proline' 0 CA--C 1.54 0.795 0 C-N-CA 123.302 2.668 . . . . 0.0 114.025 -172.737 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -61.61 129.96 29.84 Favored 'Trans proline' 0 N--CA 1.458 -0.607 0 C-N-CA 123.609 2.873 . . . . 0.0 110.998 178.856 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 75.79 1.11 66.0 Favored Glycine 0 CA--C 1.536 1.405 0 CA-C-O 117.294 -1.836 . . . . 0.0 115.893 -177.203 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 30.4 t80 -37.18 128.87 0.95 Allowed 'General case' 0 C--N 1.349 0.578 0 N-CA-C 117.155 2.28 . . . . 0.0 117.155 -179.405 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 56.1 mtm -100.01 -53.87 3.04 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 123.943 0.897 . . . . 0.0 113.025 -177.876 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 523' ' ' PHE . . . . . 0.4 ' CE2' HG21 ' A' ' 549' ' ' VAL . 29.1 p90 -165.93 170.67 13.46 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 126.497 1.919 . . . . 0.0 112.974 -174.159 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 524' ' ' LYS . . . . . 0.523 ' HE2' ' CD2' ' A' ' 548' ' ' LEU . 80.0 mttt -101.86 161.98 13.26 Favored 'General case' 0 N--CA 1.467 0.394 0 O-C-N 121.131 -0.981 . . . . 0.0 112.148 168.189 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 15.3 m -132.84 162.82 39.33 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 C-N-CA 126.471 1.909 . . . . 0.0 109.691 164.987 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 55.5 tt0 -127.12 130.62 50.18 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 118.827 0.739 . . . . 0.0 111.548 170.04 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 527' ' ' ALA . . . . . . . . . . . . . . . -59.53 130.9 49.15 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 123.693 0.797 . . . . 0.0 111.359 176.246 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 31.7 mm-40 -93.9 -25.79 17.16 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.372 1.469 . . . . 0.0 110.604 168.585 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 62.7 m-70 -132.55 164.86 25.69 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 127.03 2.132 . . . . 0.0 111.903 -176.691 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -85.07 132.27 34.34 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 106.504 -1.665 . . . . 0.0 106.504 175.891 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 90.0 t80 -120.62 109.99 15.9 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 124.071 0.948 . . . . 0.0 113.134 172.093 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 1.2 m -84.93 108.16 17.43 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 115.178 1.547 . . . . 0.0 115.178 173.638 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -64.25 144.38 57.19 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 125.951 1.7 . . . . 0.0 112.707 178.99 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 2.2 t -125.43 11.35 8.02 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 126.864 2.066 . . . . 0.0 115.44 -177.067 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 28.4 t0 -143.69 157.54 44.33 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 125.808 1.643 . . . . 0.0 107.619 177.595 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 3.2 t -69.93 -21.33 63.29 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 114.681 1.363 . . . . 0.0 114.681 165.036 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 22.9 m-20 -73.46 -19.96 60.82 Favored 'General case' 0 CA--C 1.541 0.635 0 N-CA-C 115.105 1.52 . . . . 0.0 115.105 169.497 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 73.5 mt-10 -87.13 142.34 27.99 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 125.774 1.63 . . . . 0.0 114.553 -177.425 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -88.41 131.76 34.73 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 126.717 2.007 . . . . 0.0 110.035 174.763 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -85.28 133.9 34.14 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 123.614 0.765 . . . . 0.0 110.797 172.344 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 77.0 mt -124.86 147.92 48.53 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.586 1.154 . . . . 0.0 111.957 175.574 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 7.8 tmtt? -115.47 142.98 45.99 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 126.179 1.792 . . . . 0.0 108.147 164.899 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -48.0 123.75 6.63 Favored 'General case' 0 CA--C 1.544 0.735 0 CA-C-N 119.167 0.894 . . . . 0.0 111.068 177.083 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 95.26 0.65 63.11 Favored Glycine 0 CA--C 1.534 1.245 0 C-N-CA 125.477 1.513 . . . . 0.0 114.526 -177.45 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 81.9 m-20 -72.59 119.25 16.55 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 119.249 1.525 . . . . 0.0 113.645 176.107 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 3.4 t -71.89 137.13 24.26 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.573 0 O-C-N 122.126 -0.359 . . . . 0.0 111.321 169.585 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 1.4 t -129.1 124.5 60.78 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.544 0 C-N-CA 125.625 1.57 . . . . 0.0 111.57 177.753 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 548' ' ' LEU . . . . . 0.523 ' CD2' ' HE2' ' A' ' 524' ' ' LYS . 16.7 mt -82.48 99.8 9.69 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.883 1.273 . . . . 0.0 108.581 176.756 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 549' ' ' VAL . . . . . 0.4 HG21 ' CE2' ' A' ' 523' ' ' PHE . 5.1 t -63.41 132.79 29.35 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.198 0 N-CA-C 114.692 1.367 . . . . 0.0 114.692 175.333 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 11.3 pt -129.22 156.55 78.15 Favored Pre-proline 0 CA--C 1.548 0.901 0 C-N-CA 127.09 2.156 . . . . 0.0 110.002 177.765 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -75.39 148.91 34.42 Favored 'Trans proline' 0 CA--C 1.534 0.513 0 C-N-CA 123.918 3.078 . . . . 0.0 112.058 175.678 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 552' ' ' PHE . . . . . 0.445 ' CE1' ' HA ' ' A' ' 558' ' ' GLN . 14.9 m-85 . . . . . 0 CA--C 1.538 0.5 0 N-CA-C 114.368 1.248 . . . . 0.0 114.368 179.163 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 558' ' ' GLN . . . . . 0.445 ' HA ' ' CE1' ' A' ' 552' ' ' PHE . 29.9 tt0 . . . . . 0 CA--C 1.534 0.343 0 CA-C-O 121.939 0.875 . . . . 0.0 112.276 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -142.31 144.41 33.23 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 125.83 1.652 . . . . 0.0 114.746 -179.702 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 39.0 tp10 -68.39 129.53 40.19 Favored 'General case' 0 CA--C 1.537 0.449 0 O-C-N 121.382 -0.824 . . . . 0.0 111.934 -176.526 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 83.31 -6.77 70.63 Favored Glycine 0 CA--C 1.537 1.428 0 C-N-CA 124.76 1.172 . . . . 0.0 114.436 -175.06 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 61.9 m95 -93.09 160.81 14.69 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 125.08 1.352 . . . . 0.0 112.688 174.63 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 14.0 mt -138.08 153.44 49.3 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 126.047 1.739 . . . . 0.0 109.332 168.712 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 54.4 ttm -109.69 143.51 39.37 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 124.184 0.993 . . . . 0.0 111.277 173.54 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -172.45 -171.84 37.68 Favored Glycine 0 CA--C 1.522 0.479 0 C-N-CA 123.699 0.666 . . . . 0.0 112.758 176.907 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 12.0 p -131.77 138.68 52.26 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.503 0 C-N-CA 125.03 1.332 . . . . 0.0 108.65 171.434 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 35.5 mtmt -59.18 136.71 58.04 Favored 'General case' 0 N--CA 1.467 0.404 0 O-C-N 121.272 -0.892 . . . . 0.0 110.759 178.119 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -59.19 -41.86 89.51 Favored 'General case' 0 C--O 1.219 -0.542 0 CA-C-O 117.906 -1.045 . . . . 0.0 110.37 175.654 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 38.0 t -62.39 -33.66 75.2 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 120.247 1.385 . . . . 0.0 112.467 176.781 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 77.8 m-20 -69.16 -43.9 73.37 Favored 'General case' 0 CA--C 1.542 0.666 0 N-CA-C 115.488 1.662 . . . . 0.0 115.488 173.402 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 65.7 t-105 -72.01 -31.62 66.39 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.606 1.562 . . . . 0.0 113.203 175.671 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 46.7 t-20 -76.32 -24.12 54.29 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 127.603 2.361 . . . . 0.0 111.893 172.085 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 81.2 mt-30 -80.8 -3.82 52.42 Favored 'General case' 0 CA--C 1.544 0.733 0 O-C-N 120.961 -1.087 . . . . 0.0 113.213 163.29 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 88.2 m-70 61.12 32.64 19.62 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 125.998 1.719 . . . . 0.0 113.755 171.769 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 74.3 mttt -70.03 160.48 31.89 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.711 1.604 . . . . 0.0 111.696 175.432 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 9.2 pm0 -56.29 111.59 1.01 Allowed 'General case' 0 CA--C 1.549 0.937 0 N-CA-C 113.383 0.882 . . . . 0.0 113.383 176.997 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 45.5 tp -57.54 -49.48 76.21 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 124.254 1.022 . . . . 0.0 112.872 -169.8 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 65.8 mm-40 -66.19 -16.51 64.05 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 113.828 1.047 . . . . 0.0 113.828 -174.378 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 18.3 tptm -97.34 -44.78 6.74 Favored 'General case' 0 N--CA 1.465 0.322 0 C-N-CA 125.249 1.42 . . . . 0.0 112.05 174.148 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 56.5 m -76.67 -17.09 59.33 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 114.927 1.454 . . . . 0.0 114.927 -177.153 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 7.9 ptt85 -63.33 160.12 16.61 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 123.807 0.843 . . . . 0.0 112.544 169.05 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -169.14 174.5 43.61 Favored Glycine 0 CA--C 1.526 0.775 0 CA-C-N 115.564 -0.744 . . . . 0.0 113.641 170.418 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 31.3 m -91.01 139.88 16.92 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.382 0 C-N-CA 124.706 1.203 . . . . 0.0 111.164 168.274 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 41.8 p90 -135.64 154.7 78.33 Favored Pre-proline 0 CA--C 1.539 0.55 0 C-N-CA 124.831 1.253 . . . . 0.0 112.152 174.808 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -68.38 114.44 3.46 Favored 'Trans proline' 0 CA--C 1.535 0.558 0 C-N-CA 122.103 1.869 . . . . 0.0 110.103 170.66 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 15.4 pt-20 -54.02 -30.63 48.35 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.835 0.854 . . . . 0.0 112.617 -179.22 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 7.3 p-10 -70.03 -18.08 63.28 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 127.041 2.137 . . . . 0.0 113.481 -177.432 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 19.6 m-85 -72.4 -11.08 60.53 Favored 'General case' 0 CA--C 1.536 0.409 0 N-CA-C 116.442 2.016 . . . . 0.0 116.442 163.507 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 589' ' ' THR . . . . . . . . . . . . . 34.2 p -125.29 178.42 5.6 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 126.331 1.852 . . . . 0.0 112.675 -175.902 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -131.43 140.1 49.54 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 125.458 1.503 . . . . 0.0 110.089 169.983 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -64.11 114.19 4.01 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 124.767 1.227 . . . . 0.0 109.855 171.68 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 592' ' ' VAL . . . . . 0.52 HG23 ' HB2' ' A' ' 524' ' ' LYS . 1.3 m . . . . . 0 N--CA 1.478 0.952 0 C-N-CA 125.308 1.443 . . . . 0.0 108.977 176.99 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo . . . . . 0 CA--C 1.54 0.799 0 CA-C-O 121.552 0.563 . . . . 0.0 112.95 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 3.5 t -134.62 131.71 54.09 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 C-N-CA 125.276 1.431 . . . . 0.0 112.443 -178.087 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -68.52 133.43 90.91 Favored Pre-proline 0 CA--C 1.548 0.897 0 O-C-N 121.443 -0.786 . . . . 0.0 111.491 -176.321 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -78.58 165.13 25.37 Favored 'Trans proline' 0 CA--C 1.548 1.186 0 C-N-CA 122.982 2.455 . . . . 0.0 113.088 -178.334 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo . . . . . 0 CA--C 1.539 0.735 0 C-N-CA 123.533 2.822 . . . . 0.0 114.028 179.263 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 517' ' ' LEU . . . . . 0.477 HD22 HD22 ' A' ' 548' ' ' LEU . 13.4 mt . . . . . 0 CA--C 1.538 0.517 0 CA-C-O 120.545 0.212 . . . . 0.0 110.526 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_endo -65.01 160.95 39.04 Favored 'Trans proline' 0 CA--C 1.538 0.695 0 C-N-CA 122.846 2.364 . . . . 0.0 113.484 -173.253 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -58.17 135.4 68.09 Favored 'Trans proline' 0 N--CA 1.46 -0.5 0 C-N-CA 122.893 2.396 . . . . 0.0 110.541 176.911 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 69.9 0.77 28.58 Favored Glycine 0 CA--C 1.535 1.308 0 CA-C-O 117.357 -1.802 . . . . 0.0 115.893 -178.677 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 34.7 t80 -36.29 125.28 0.79 Allowed 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 121.057 2.428 . . . . 0.0 116.814 -178.538 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 63.0 mtm -98.92 -53.31 3.31 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 123.344 0.658 . . . . 0.0 112.344 -177.15 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 523' ' ' PHE . . . . . . . . . . . . . 26.8 p90 -164.39 169.14 17.75 Favored 'General case' 0 C--O 1.223 -0.318 0 C-N-CA 126.332 1.853 . . . . 0.0 112.834 -174.093 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 524' ' ' LYS . . . . . 0.562 ' HE2' ' CD2' ' A' ' 548' ' ' LEU . 87.9 mttt -100.83 163.12 12.46 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 122.219 1.009 . . . . 0.0 111.253 166.938 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 17.3 m -135.45 161.6 38.9 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 C-N-CA 126.248 1.819 . . . . 0.0 109.016 165.92 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 58.0 tt0 -124.54 130.02 51.68 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 118.39 0.541 . . . . 0.0 111.877 169.848 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 527' ' ' ALA . . . . . 0.417 ' HA ' HG22 ' A' ' 589' ' ' THR . . . -59.59 124.13 19.1 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.988 0.915 . . . . 0.0 111.95 177.341 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 75.6 mm-40 -87.94 -25.74 23.05 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.127 1.371 . . . . 0.0 112.298 173.769 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 59.0 m-70 -139.2 167.81 21.24 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 127.177 2.191 . . . . 0.0 109.221 178.522 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 10.6 p-10 -85.22 138.81 32.11 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 125.071 1.348 . . . . 0.0 114.512 174.609 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 89.7 t80 -133.12 107.55 8.28 Favored 'General case' 0 C--O 1.235 0.299 0 C-N-CA 125.09 1.356 . . . . 0.0 111.803 179.198 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 532' ' ' THR . . . . . . . . . . . . 0.251 0.6 OUTLIER -81.61 104.55 12.1 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 113.697 0.999 . . . . 0.0 113.697 170.884 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -59.7 133.05 55.74 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 125.337 1.455 . . . . 0.0 110.895 176.986 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 4.4 t -109.1 -10.48 15.0 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.618 1.567 . . . . 0.0 115.047 -171.935 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 12.3 m-20 -133.45 153.36 51.68 Favored 'General case' 0 N--CA 1.463 0.209 0 C-N-CA 126.38 1.872 . . . . 0.0 115.745 176.929 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 536' ' ' THR . . . . . . . . . . . . 0.252 1.3 t -62.43 -27.42 69.1 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 116.582 2.067 . . . . 0.0 116.582 -171.301 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 87.2 m-20 -72.54 -17.49 61.72 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 116.407 2.002 . . . . 0.0 116.407 171.13 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 82.6 mt-10 -82.27 149.78 27.63 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.383 1.473 . . . . 0.0 114.243 -177.343 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -97.89 128.71 44.66 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 126.638 1.975 . . . . 0.0 110.422 177.651 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 15.3 tt0 -86.15 127.81 34.78 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 123.613 0.765 . . . . 0.0 111.549 178.495 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 76.9 mt -122.43 143.97 49.34 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 124.7 1.2 . . . . 0.0 112.295 -178.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 6.6 tmtm? -115.78 147.42 40.99 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 126.23 1.812 . . . . 0.0 109.329 169.717 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -54.12 120.49 6.52 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-O 121.993 0.901 . . . . 0.0 110.888 -179.613 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 100.47 0.79 55.56 Favored Glycine 0 CA--C 1.529 0.917 0 C-N-CA 125.381 1.467 . . . . 0.0 114.756 -178.481 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 80.8 m-20 -70.86 122.59 20.21 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 119.303 1.552 . . . . 0.0 113.77 -179.516 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 58.7 t -69.9 133.99 30.9 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.614 0 N-CA-C 109.198 -0.668 . . . . 0.0 109.198 166.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -126.69 124.16 64.47 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.503 0 C-N-CA 124.794 1.238 . . . . 0.0 111.41 171.757 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 548' ' ' LEU . . . . . 0.562 ' CD2' ' HE2' ' A' ' 524' ' ' LYS . 20.0 mt -80.13 100.07 8.06 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.547 1.139 . . . . 0.0 108.477 175.621 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 549' ' ' VAL . . . . . . . . . . . . . 4.1 t -63.51 132.0 29.23 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.224 0 N-CA-C 114.688 1.366 . . . . 0.0 114.688 173.837 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 17.0 pt -128.12 155.65 77.68 Favored Pre-proline 0 CA--C 1.544 0.739 0 C-N-CA 126.54 1.936 . . . . 0.0 110.435 179.186 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -70.52 152.77 65.6 Favored 'Trans proline' 0 N--CA 1.459 -0.53 0 C-N-CA 123.548 2.832 . . . . 0.0 110.619 171.329 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 52.2 m-85 . . . . . 0 C--N 1.329 -0.321 0 N-CA-C 115.792 1.775 . . . . 0.0 115.792 -176.706 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 40.1 tt0 . . . . . 0 N--CA 1.468 0.472 0 N-CA-C 113.669 0.989 . . . . 0.0 113.669 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 25.7 m-20 -127.43 149.65 49.99 Favored 'General case' 0 CA--C 1.553 1.079 0 C-N-CA 125.411 1.485 . . . . 0.0 110.8 -178.141 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -70.77 120.25 16.09 Favored 'General case' 0 N--CA 1.477 0.905 0 O-C-N 120.637 -1.289 . . . . 0.0 112.813 -170.331 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 83.68 -0.11 89.67 Favored Glycine 0 CA--C 1.54 1.636 0 C-N-CA 124.422 1.01 . . . . 0.0 115.275 -173.754 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 53.8 m95 -90.34 164.71 14.23 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 125.285 1.434 . . . . 0.0 113.437 176.102 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 11.4 mt -134.06 161.23 35.43 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 125.256 1.422 . . . . 0.0 110.517 165.657 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 55.8 ttm -116.01 145.91 42.58 Favored 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 124.853 1.261 . . . . 0.0 112.018 171.59 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -172.56 -169.44 35.2 Favored Glycine 0 CA--C 1.525 0.673 0 C-N-CA 124.402 1.001 . . . . 0.0 112.434 178.073 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 14.7 p -136.6 141.57 40.62 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 C-N-CA 125.731 1.612 . . . . 0.0 109.461 173.636 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 37.1 mtmt -58.07 135.22 56.96 Favored 'General case' 0 N--CA 1.469 0.518 0 O-C-N 121.138 -0.976 . . . . 0.0 110.788 174.967 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 19.5 tt0 -60.76 -39.0 87.16 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 119.636 -0.826 . . . . 0.0 110.186 174.273 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 47.3 t -58.09 -37.36 74.36 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 124.293 1.037 . . . . 0.0 112.427 177.15 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 -74.19 -44.28 54.01 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 114.959 1.466 . . . . 0.0 114.959 175.861 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 60.3 t-105 -67.67 -32.29 72.86 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.589 1.156 . . . . 0.0 112.975 176.562 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 26.7 t-20 -66.48 -35.66 80.83 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 126.414 1.886 . . . . 0.0 112.278 174.221 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 75.5 mt-30 -75.9 -5.7 47.36 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 125.566 1.546 . . . . 0.0 113.649 175.241 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 95.8 m-70 56.43 48.16 17.44 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 125.136 1.374 . . . . 0.0 112.66 -178.123 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 26.9 mttp -75.76 162.25 28.35 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 124.961 1.305 . . . . 0.0 111.778 166.533 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 14.1 pm0 -63.88 103.14 0.54 Allowed 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.379 1.072 . . . . 0.0 112.747 177.761 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 32.4 tp -58.31 -35.56 72.05 Favored 'General case' 0 CA--C 1.537 0.449 0 O-C-N 121.212 -0.93 . . . . 0.0 111.903 -174.515 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -65.08 -16.06 63.05 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 124.59 1.156 . . . . 0.0 113.885 -179.17 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 32.1 mmtp -114.28 -39.98 3.76 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 125.585 1.554 . . . . 0.0 112.442 177.623 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 39.1 m -70.51 -24.83 62.9 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 114.221 1.193 . . . . 0.0 114.221 177.063 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 17.3 ptp180 -62.01 160.97 11.46 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-N 118.91 0.777 . . . . 0.0 111.777 169.104 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -173.49 172.44 45.2 Favored Glycine 0 CA--C 1.521 0.468 0 CA-C-N 115.401 -0.818 . . . . 0.0 114.078 175.823 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 31.9 m -89.35 139.19 17.83 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.387 0 C-N-CA 124.282 1.033 . . . . 0.0 111.374 169.738 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 40.7 p90 -133.6 154.8 80.88 Favored Pre-proline 0 CA--C 1.541 0.628 0 C-N-CA 124.62 1.168 . . . . 0.0 112.889 173.381 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -65.61 110.75 1.7 Allowed 'Trans proline' 0 C--N 1.346 0.436 0 C-N-CA 122.039 1.826 . . . . 0.0 109.275 168.658 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 17.5 pt-20 -57.51 -26.93 62.07 Favored 'General case' 0 N--CA 1.474 0.744 0 O-C-N 121.506 -0.746 . . . . 0.0 112.32 -176.799 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 13.3 p-10 -71.51 -12.45 61.38 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 127.063 2.145 . . . . 0.0 114.64 178.278 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 18.4 m-85 -74.31 -13.74 60.8 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 116.862 2.171 . . . . 0.0 116.862 163.731 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 589' ' ' THR . . . . . 0.417 HG22 ' HA ' ' A' ' 527' ' ' ALA . 58.7 p -122.63 173.21 7.86 Favored 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 125.671 1.588 . . . . 0.0 111.893 -174.222 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -127.72 136.41 51.5 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 123.916 0.887 . . . . 0.0 109.691 171.731 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -64.33 120.09 11.55 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 125.567 1.547 . . . . 0.0 109.221 178.579 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 592' ' ' VAL . . . . . 0.524 HG23 ' HB2' ' A' ' 524' ' ' LYS . 2.3 m . . . . . 0 N--CA 1.476 0.86 0 C-N-CA 124.944 1.298 . . . . 0.0 108.329 177.539 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 88.9 Cg_endo . . . . . 0 CA--C 1.539 0.771 0 CA-C-O 121.343 0.476 . . . . 0.0 112.612 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 4.0 p -140.26 147.35 23.49 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 C-N-CA 125.958 1.703 . . . . 0.0 109.301 170.948 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -72.34 141.55 83.42 Favored Pre-proline 0 CA--C 1.554 1.101 0 N-CA-C 113.401 0.889 . . . . 0.0 113.401 -173.641 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -79.12 168.54 20.34 Favored 'Trans proline' 0 CA--C 1.552 1.396 0 C-N-CA 123.451 2.767 . . . . 0.0 113.378 178.061 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 35.9 Cg_exo . . . . . 0 CA--C 1.539 0.729 0 C-N-CA 124.217 3.278 . . . . 0.0 114.19 -179.694 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 517' ' ' LEU . . . . . 0.422 HD22 HD22 ' A' ' 548' ' ' LEU . 10.3 mt . . . . . 0 CA--C 1.55 0.973 0 CA-C-O 119.872 -0.109 . . . . 0.0 111.249 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -66.43 161.51 40.66 Favored 'Trans proline' 0 CA--C 1.538 0.709 0 C-N-CA 123.477 2.785 . . . . 0.0 114.287 -173.759 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -61.19 128.53 25.41 Favored 'Trans proline' 0 N--CA 1.459 -0.519 0 C-N-CA 123.244 2.63 . . . . 0.0 111.098 -179.4 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 73.03 6.84 69.22 Favored Glycine 0 CA--C 1.534 1.257 0 CA-C-O 117.453 -1.748 . . . . 0.0 116.238 -178.116 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 35.1 t80 -37.88 135.68 0.63 Allowed 'General case' 0 CA--C 1.547 0.865 0 CA-C-N 120.852 2.326 . . . . 0.0 117.134 -179.997 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 60.8 mtm -109.26 -51.5 2.87 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.448 0.699 . . . . 0.0 112.832 -179.099 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 523' ' ' PHE . . . . . . . . . . . . . 23.7 p90 -165.54 167.41 17.45 Favored 'General case' 0 C--O 1.223 -0.314 0 C-N-CA 125.984 1.713 . . . . 0.0 114.018 -174.018 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 524' ' ' LYS . . . . . 0.581 ' HB2' HG23 ' A' ' 592' ' ' VAL . 69.6 mttt -99.7 164.05 12.22 Favored 'General case' 0 N--CA 1.47 0.535 0 O-C-N 121.389 -0.819 . . . . 0.0 111.664 166.312 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 17.8 m -139.45 156.12 26.38 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.975 0 C-N-CA 126.952 2.101 . . . . 0.0 109.007 167.685 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 63.8 tt0 -119.01 128.88 54.79 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 119.157 0.889 . . . . 0.0 112.007 170.912 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 527' ' ' ALA . . . . . 0.459 ' HA ' HG22 ' A' ' 589' ' ' THR . . . -60.26 117.82 5.65 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.708 1.203 . . . . 0.0 111.726 176.434 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 65.4 mm-40 -81.44 -26.36 35.4 Favored 'General case' 0 CA--C 1.537 0.442 0 C-N-CA 124.741 1.217 . . . . 0.0 111.076 170.58 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 81.3 m-70 -138.11 164.27 29.55 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 125.36 1.464 . . . . 0.0 112.476 -175.441 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . 0.253 1.7 p30 -77.41 132.33 38.45 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 115.015 1.487 . . . . 0.0 115.015 176.305 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 79.2 t80 -137.82 122.1 18.17 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 113.728 1.011 . . . . 0.0 113.728 176.707 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -87.44 125.14 34.11 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 114.665 1.357 . . . . 0.0 114.665 175.071 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -66.56 129.7 40.71 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-O 121.122 0.486 . . . . 0.0 110.851 169.561 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 4.6 p -97.9 -36.02 10.3 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 126.496 1.918 . . . . 0.0 113.777 171.436 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 96.4 m-20 -95.09 156.44 16.32 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 125.262 1.425 . . . . 0.0 114.642 176.197 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 7.7 t -54.99 -29.48 57.25 Favored 'General case' 0 N--CA 1.472 0.625 0 N-CA-C 114.665 1.357 . . . . 0.0 114.665 164.822 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 90.8 m-20 -104.97 6.13 33.26 Favored 'General case' 0 CA--C 1.544 0.726 0 N-CA-C 115.353 1.612 . . . . 0.0 115.353 175.867 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 57.3 mt-10 -86.19 152.11 23.09 Favored 'General case' 0 CA--C 1.541 0.621 0 O-C-N 120.392 -1.443 . . . . 0.0 111.103 165.0 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -101.87 132.92 47.37 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.92 1.288 . . . . 0.0 111.201 -176.294 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 29.1 tt0 -82.91 127.93 33.97 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 123.999 0.919 . . . . 0.0 109.941 174.354 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 85.0 mt -130.34 139.98 50.65 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 125.234 1.413 . . . . 0.0 111.696 -179.248 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 3.7 tmtt? -110.07 145.93 36.24 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 125.716 1.607 . . . . 0.0 110.048 168.085 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -54.54 96.06 0.01 OUTLIER 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 124.527 1.131 . . . . 0.0 112.085 173.113 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 134.01 -10.71 4.8 Favored Glycine 0 CA--C 1.536 1.377 0 C-N-CA 126.948 2.213 . . . . 0.0 114.717 -175.72 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 79.8 m-20 -77.88 127.35 32.25 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 114.962 1.467 . . . . 0.0 114.962 -170.272 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 1.9 t -77.27 135.94 25.45 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.827 0 N-CA-C 113.235 0.828 . . . . 0.0 113.235 167.899 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 1.4 t -124.59 121.91 62.55 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.358 0 C-N-CA 125.97 1.708 . . . . 0.0 110.996 175.843 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 548' ' ' LEU . . . . . 0.447 HD23 ' HG2' ' A' ' 524' ' ' LYS . 18.4 mt -77.22 101.98 6.45 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 108.212 -1.033 . . . . 0.0 108.212 172.202 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 549' ' ' VAL . . . . . . . . . . . . . 7.5 t -64.25 133.58 29.71 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.23 0 N-CA-C 114.548 1.314 . . . . 0.0 114.548 173.694 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 14.9 pt -130.2 159.27 71.2 Favored Pre-proline 0 CA--C 1.544 0.735 0 C-N-CA 126.728 2.011 . . . . 0.0 109.595 -178.348 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -71.1 141.72 40.47 Favored 'Trans proline' 0 C--O 1.24 0.62 0 C-N-CA 123.16 2.573 . . . . 0.0 111.83 175.848 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 45.4 m-85 . . . . . 0 C--O 1.236 0.345 0 N-CA-C 115.179 1.548 . . . . 0.0 115.179 166.455 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 40.7 tt0 . . . . . 0 CA--C 1.532 0.279 0 CA-C-O 121.781 0.801 . . . . 0.0 112.503 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 53.6 m-20 -85.31 142.3 29.44 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.884 1.274 . . . . 0.0 112.529 171.987 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 52.6 tp10 -78.36 131.81 37.14 Favored 'General case' 0 N--CA 1.469 0.512 0 O-C-N 120.292 -1.505 . . . . 0.0 111.368 -170.36 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 80.61 -4.05 71.0 Favored Glycine 0 CA--C 1.537 1.442 0 O-C-N 121.636 -0.665 . . . . 0.0 114.37 -173.133 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 47.5 m95 -89.75 165.27 14.27 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.21 1.404 . . . . 0.0 112.654 172.721 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 14.4 mt -134.87 154.82 51.5 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 125.545 1.538 . . . . 0.0 110.004 167.663 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 35.8 tpp -110.68 142.24 42.85 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 125.188 1.395 . . . . 0.0 110.863 171.651 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -165.07 -174.62 34.96 Favored Glycine 0 CA--C 1.526 0.744 0 O-C-N 121.336 -0.852 . . . . 0.0 113.561 174.922 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 13.0 p -130.62 139.71 50.58 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 C-N-CA 125.026 1.33 . . . . 0.0 108.8 169.341 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 36.3 mtmt -57.07 137.05 56.29 Favored 'General case' 0 N--CA 1.467 0.375 0 O-C-N 121.4 -0.813 . . . . 0.0 111.36 176.205 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 47.5 tt0 -60.96 -38.9 87.52 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-O 118.411 -0.804 . . . . 0.0 111.126 178.44 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 61.8 m -68.96 -31.91 71.12 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 119.504 1.047 . . . . 0.0 113.495 175.934 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 -65.57 -42.71 91.49 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 122.473 1.13 . . . . 0.0 113.924 170.057 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 46.9 t-105 -78.05 -27.58 48.75 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.668 1.187 . . . . 0.0 113.832 178.803 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 5.3 t-20 -67.04 -34.05 76.86 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 119.724 1.147 . . . . 0.0 110.98 173.922 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 39.3 mt-30 -73.83 -11.0 60.24 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 113.909 1.077 . . . . 0.0 113.909 165.492 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 68.7 m-70 56.68 38.44 29.54 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.434 1.494 . . . . 0.0 113.339 -178.252 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 62.5 mttt -60.82 162.82 6.31 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 125.221 1.409 . . . . 0.0 112.52 172.051 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -48.49 95.41 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 126.947 2.099 . . . . 0.0 113.867 174.786 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 49.9 tp -52.85 -47.8 67.52 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 125.801 1.64 . . . . 0.0 111.933 -169.744 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -63.33 -20.7 65.73 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 125.333 1.453 . . . . 0.0 114.601 -175.166 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 32.7 mmtp -102.73 -43.35 5.6 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.288 1.035 . . . . 0.0 111.756 176.218 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 62.1 m -63.22 -30.94 71.99 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 113.907 1.077 . . . . 0.0 113.907 176.48 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 2.7 ptt85 -62.57 166.1 5.65 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-O 122.32 1.057 . . . . 0.0 113.151 175.498 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -177.94 171.0 43.48 Favored Glycine 0 CA--C 1.524 0.646 0 CA-C-N 114.22 -1.355 . . . . 0.0 113.275 170.975 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 31.7 m -87.44 145.27 7.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 C-N-CA 124.983 1.313 . . . . 0.0 110.394 171.098 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 44.2 p90 -141.23 155.37 68.06 Favored Pre-proline 0 C--O 1.24 0.579 0 C-N-CA 124.115 0.966 . . . . 0.0 113.285 175.652 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -66.82 108.56 1.49 Allowed 'Trans proline' 0 N--CA 1.458 -0.561 0 C-N-CA 122.245 1.963 . . . . 0.0 109.489 169.515 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 17.7 pt-20 -55.5 -27.64 49.82 Favored 'General case' 0 N--CA 1.475 0.776 0 O-C-N 121.457 -0.777 . . . . 0.0 112.588 -177.533 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 11.5 p-10 -67.13 -21.66 65.82 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 125.967 1.707 . . . . 0.0 113.872 178.177 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 13.4 m-85 -68.53 -15.35 63.51 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 116.412 2.004 . . . . 0.0 116.412 166.407 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 589' ' ' THR . . . . . 0.459 HG22 ' HA ' ' A' ' 527' ' ' ALA . 62.7 p -120.62 174.85 6.31 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 126.065 1.746 . . . . 0.0 111.18 -177.473 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -135.64 139.77 44.02 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.886 0.874 . . . . 0.0 109.802 171.986 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -61.13 134.2 56.8 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 126.851 2.06 . . . . 0.0 112.157 -177.573 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 592' ' ' VAL . . . . . 0.581 HG23 ' HB2' ' A' ' 524' ' ' LYS . 3.5 m . . . . . 0 CA--C 1.546 0.806 0 C-N-CA 124.169 0.988 . . . . 0.0 109.854 177.295 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 78.9 Cg_endo . . . . . 0 CA--C 1.539 0.754 0 CA-C-O 122.064 0.777 . . . . 0.0 113.616 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 47.0 t -136.28 134.62 49.95 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.94 0 C-N-CA 126.294 1.837 . . . . 0.0 109.643 178.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -67.52 142.56 96.37 Favored Pre-proline 0 CA--C 1.551 0.991 0 N-CA-C 112.882 0.697 . . . . 0.0 112.882 -173.551 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -73.71 162.13 40.3 Favored 'Trans proline' 0 CA--C 1.539 0.731 0 C-N-CA 122.762 2.308 . . . . 0.0 111.861 176.385 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo . . . . . 0 CA--C 1.539 0.76 0 C-N-CA 122.812 2.341 . . . . 0.0 112.179 178.676 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 10.0 mt . . . . . 0 CA--C 1.544 0.718 0 N-CA-C 112.343 0.498 . . . . 0.0 112.343 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -66.91 160.39 47.2 Favored 'Trans proline' 0 CA--C 1.538 0.695 0 C-N-CA 123.755 2.97 . . . . 0.0 113.581 -173.774 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -63.99 135.67 48.84 Favored 'Trans proline' 0 N--CA 1.456 -0.732 0 C-N-CA 123.135 2.557 . . . . 0.0 109.787 178.997 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 70.6 1.57 38.29 Favored Glycine 0 CA--C 1.535 1.314 0 CA-C-O 116.693 -2.17 . . . . 0.0 116.306 -176.299 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 30.5 t80 -35.61 135.84 0.26 Allowed 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 117.573 2.434 . . . . 0.0 117.573 -178.631 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 44.9 mtm -103.99 -64.64 1.08 Allowed 'General case' 0 C--O 1.237 0.406 0 C-N-CA 123.271 0.628 . . . . 0.0 111.595 179.872 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 523' ' ' PHE . . . . . 0.437 ' CE2' HG21 ' A' ' 549' ' ' VAL . 41.6 p90 -158.78 174.55 14.85 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 124.781 1.232 . . . . 0.0 112.881 -175.39 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 524' ' ' LYS . . . . . 0.539 ' HE2' ' CD2' ' A' ' 548' ' ' LEU . 78.8 mttt -108.0 160.93 15.4 Favored 'General case' 0 N--CA 1.472 0.661 0 O-C-N 121.173 -0.954 . . . . 0.0 112.593 173.524 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 16.7 m -136.5 159.7 37.86 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 C-N-CA 126.698 1.999 . . . . 0.0 109.926 167.385 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 60.7 tt0 -122.55 130.88 53.5 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 124.031 0.932 . . . . 0.0 112.591 169.749 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 527' ' ' ALA . . . . . 0.424 ' HA ' HG22 ' A' ' 589' ' ' THR . . . -63.44 121.42 13.78 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.753 1.221 . . . . 0.0 112.613 178.289 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 60.6 mm-40 -84.32 -22.75 30.53 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.345 1.458 . . . . 0.0 111.986 172.974 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 97.7 m-70 -142.72 161.88 36.93 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 126.418 1.887 . . . . 0.0 111.135 -168.672 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -87.8 123.39 32.54 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.981 1.712 . . . . 0.0 115.344 -179.729 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 78.2 t80 -130.56 113.45 14.25 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 124.33 1.052 . . . . 0.0 112.148 -176.241 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 1.2 m -89.33 127.07 35.76 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 124.636 1.175 . . . . 0.0 114.075 169.561 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -74.13 132.12 41.95 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-O 122.545 1.165 . . . . 0.0 112.778 -173.912 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 534' ' ' THR . . . . . . . . . . . . 0.289 3.3 t -108.97 14.88 23.82 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 126.214 1.806 . . . . 0.0 114.624 -177.928 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 24.9 t0 -150.7 159.34 44.58 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.86 1.264 . . . . 0.0 108.074 175.837 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 1.4 t -72.54 -10.43 59.78 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 115.01 1.485 . . . . 0.0 115.01 167.45 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 95.4 m-20 -76.64 -25.24 53.6 Favored 'General case' 0 N--CA 1.47 0.547 0 N-CA-C 116.379 1.992 . . . . 0.0 116.379 162.968 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 70.6 mt-10 -87.17 153.64 21.35 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 114.229 1.196 . . . . 0.0 114.229 -166.598 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -100.04 129.35 46.08 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 126.91 2.084 . . . . 0.0 110.051 176.549 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 18.4 tt0 -80.43 130.27 35.05 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.474 0.709 . . . . 0.0 110.198 173.183 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 78.2 mt -124.58 146.64 48.93 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 124.771 1.229 . . . . 0.0 111.067 176.721 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -116.77 149.21 40.3 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 124.474 1.11 . . . . 0.0 109.403 167.071 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -54.29 105.91 0.17 Allowed 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 123.233 0.613 . . . . 0.0 111.753 176.097 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 121.31 -8.64 10.32 Favored Glycine 0 CA--C 1.534 1.25 0 C-N-CA 126.678 2.085 . . . . 0.0 114.1 -177.826 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 84.6 m-20 -78.91 123.91 27.73 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 119.414 1.607 . . . . 0.0 114.757 -172.679 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 2.4 t -73.17 138.8 20.62 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 C-N-CA 123.74 0.816 . . . . 0.0 112.049 171.816 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -129.13 124.69 61.11 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.41 0 C-N-CA 125.192 1.397 . . . . 0.0 111.594 176.567 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 548' ' ' LEU . . . . . 0.539 ' CD2' ' HE2' ' A' ' 524' ' ' LYS . 17.3 mt -81.23 98.27 8.02 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.568 1.147 . . . . 0.0 108.134 176.252 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 549' ' ' VAL . . . . . 0.437 HG21 ' CE2' ' A' ' 523' ' ' PHE . 3.0 t -57.74 125.05 13.12 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.111 0 N-CA-C 113.548 0.944 . . . . 0.0 113.548 169.579 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 6.0 pt -122.76 157.53 59.51 Favored Pre-proline 0 N--CA 1.473 0.722 0 C-N-CA 126.641 1.976 . . . . 0.0 108.981 178.437 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -63.83 149.62 90.29 Favored 'Trans proline' 0 N--CA 1.461 -0.41 0 C-N-CA 122.635 2.223 . . . . 0.0 110.272 173.863 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 552' ' ' PHE . . . . . 0.426 ' CE1' ' HA ' ' A' ' 558' ' ' GLN . 29.3 m-85 . . . . . 0 C--N 1.33 -0.26 0 N-CA-C 116.188 1.921 . . . . 0.0 116.188 179.699 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 558' ' ' GLN . . . . . 0.426 ' HA ' ' CE1' ' A' ' 552' ' ' PHE . 40.6 tt0 . . . . . 0 C--O 1.236 0.387 0 N-CA-C 113.782 1.03 . . . . 0.0 113.782 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -125.93 144.26 50.76 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 125.005 1.322 . . . . 0.0 108.665 -170.954 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -77.64 129.9 36.16 Favored 'General case' 0 N--CA 1.475 0.782 0 O-C-N 120.205 -1.559 . . . . 0.0 112.666 -171.35 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 81.41 -0.42 87.84 Favored Glycine 0 CA--C 1.539 1.543 0 C-N-CA 124.37 0.986 . . . . 0.0 114.703 -172.967 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 54.0 m95 -102.59 162.69 12.73 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 126.789 2.036 . . . . 0.0 112.508 175.14 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 11.1 mt -138.74 154.86 48.57 Favored 'General case' 0 N--CA 1.472 0.655 0 O-C-N 121.146 -0.971 . . . . 0.0 110.894 172.864 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 48.3 ttm -112.79 139.88 48.04 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 124.983 1.313 . . . . 0.0 111.718 -179.164 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -170.08 -174.77 38.52 Favored Glycine 0 CA--C 1.522 0.528 0 C-N-CA 124.292 0.948 . . . . 0.0 112.732 178.264 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 13.8 p -128.24 140.29 49.6 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.493 0 C-N-CA 125.48 1.512 . . . . 0.0 109.118 170.416 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 36.3 mtmt -59.89 136.17 57.92 Favored 'General case' 0 N--CA 1.465 0.317 0 O-C-N 121.459 -0.775 . . . . 0.0 111.056 176.694 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -57.94 -40.55 80.78 Favored 'General case' 0 C--O 1.22 -0.453 0 CA-C-O 118.096 -0.954 . . . . 0.0 110.558 176.927 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 52.3 m -59.32 -44.05 92.63 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 119.903 1.228 . . . . 0.0 113.017 175.11 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -62.64 -35.2 78.85 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 115.336 1.606 . . . . 0.0 115.336 173.465 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 69.6 t-105 -79.54 -31.86 42.13 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.63 1.172 . . . . 0.0 113.332 175.476 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 21.8 t-20 -71.69 -30.23 65.45 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 126.332 1.853 . . . . 0.0 111.845 177.913 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 50.6 mt-30 -83.11 3.49 30.45 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 114.022 1.119 . . . . 0.0 114.022 171.127 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 55.3 m-70 57.93 30.18 18.74 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 126.316 1.846 . . . . 0.0 114.148 178.963 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 45.5 mttt -68.01 161.54 26.41 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 124.838 1.255 . . . . 0.0 111.351 174.296 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 20.0 pt-20 -56.4 105.92 0.24 Allowed 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 124.654 1.181 . . . . 0.0 114.122 -177.64 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 42.5 tp -54.39 -48.86 71.06 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 125.094 1.357 . . . . 0.0 112.14 -173.827 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 21.1 pm0 -59.05 -18.83 38.39 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 126.301 1.84 . . . . 0.0 114.974 -177.508 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 66.7 mmtt -124.74 -8.68 7.31 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 115.606 1.706 . . . . 0.0 115.606 177.403 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 97.9 m -80.16 -32.34 38.82 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 123.984 0.914 . . . . 0.0 112.27 163.422 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 36.4 ptt180 -61.61 157.12 18.17 Favored 'General case' 0 N--CA 1.474 0.733 0 O-C-N 121.378 -0.826 . . . . 0.0 112.724 174.944 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -170.2 174.86 44.3 Favored Glycine 0 CA--C 1.524 0.634 0 C-N-CA 124.643 1.116 . . . . 0.0 113.139 174.996 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 21.5 m -93.77 142.67 12.96 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 C-N-CA 124.553 1.141 . . . . 0.0 111.682 169.427 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 38.9 p90 -136.18 154.48 77.36 Favored Pre-proline 0 CA--C 1.539 0.525 0 C-N-CA 125.057 1.343 . . . . 0.0 112.863 176.699 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -66.21 112.85 2.43 Favored 'Trans proline' 0 N--CA 1.457 -0.65 0 C-N-CA 121.62 1.547 . . . . 0.0 108.845 169.57 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 22.1 pt-20 -52.73 -33.35 47.62 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 123.265 0.626 . . . . 0.0 111.821 -179.37 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 9.8 p-10 -69.99 -10.84 60.01 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 127.473 2.309 . . . . 0.0 114.636 -178.637 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 16.5 m-85 -77.24 -11.68 59.86 Favored 'General case' 0 N--CA 1.468 0.466 0 N-CA-C 116.82 2.155 . . . . 0.0 116.82 162.199 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 589' ' ' THR . . . . . 0.424 HG22 ' HA ' ' A' ' 527' ' ' ALA . 67.8 p -129.82 170.47 13.84 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 125.992 1.717 . . . . 0.0 111.779 -174.272 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -131.36 137.49 48.76 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 124.162 0.985 . . . . 0.0 110.74 175.985 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 12.9 tpt180 -56.98 135.12 56.21 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 126.366 1.866 . . . . 0.0 112.023 177.388 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 592' ' ' VAL . . . . . 0.52 HG23 ' HB2' ' A' ' 524' ' ' LYS . 2.1 m . . . . . 0 N--CA 1.481 1.084 0 C-N-CA 125.975 1.71 . . . . 0.0 109.304 176.13 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo . . . . . 0 CA--C 1.539 0.761 0 N-CA-C 114.459 0.907 . . . . 0.0 114.459 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 65.6 t -129.86 133.82 64.07 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.842 0 C-N-CA 126.268 1.827 . . . . 0.0 109.709 177.379 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -68.51 132.22 91.29 Favored Pre-proline 0 CA--C 1.549 0.912 0 O-C-N 121.651 -0.655 . . . . 0.0 111.887 179.764 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -75.78 167.0 27.19 Favored 'Trans proline' 0 CA--C 1.544 0.979 0 C-N-CA 122.134 1.889 . . . . 0.0 112.019 -177.503 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 73.8 Cg_exo . . . . . 0 C--N 1.347 0.5 0 C-N-CA 124.012 3.141 . . . . 0.0 112.654 169.931 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 517' ' ' LEU . . . . . 0.482 HD22 HD22 ' A' ' 548' ' ' LEU . 10.4 mt . . . . . 0 CA--C 1.537 0.475 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -65.52 158.22 54.17 Favored 'Trans proline' 0 CA--C 1.537 0.674 0 C-N-CA 123.882 3.055 . . . . 0.0 113.756 -169.482 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -62.2 133.42 43.61 Favored 'Trans proline' 0 N--CA 1.456 -0.733 0 C-N-CA 123.306 2.671 . . . . 0.0 109.809 177.705 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 75.13 3.17 68.52 Favored Glycine 0 CA--C 1.534 1.247 0 CA-C-O 117.73 -1.594 . . . . 0.0 115.432 -175.347 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 37.2 t80 -42.6 125.55 3.34 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 121.024 2.412 . . . . 0.0 116.21 178.951 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 60.5 mtm -97.06 -47.76 5.66 Favored 'General case' 0 N--CA 1.471 0.575 0 C-N-CA 123.782 0.833 . . . . 0.0 112.546 -177.195 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 523' ' ' PHE . . . . . 0.442 ' CE1' HG21 ' A' ' 549' ' ' VAL . 23.8 p90 -171.15 167.19 7.15 Favored 'General case' 0 C--O 1.223 -0.321 0 C-N-CA 128.177 2.591 . . . . 0.0 112.504 -176.404 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 524' ' ' LYS . . . . . 0.562 ' HG2' HD23 ' A' ' 548' ' ' LEU . 85.1 mttt -96.9 160.71 14.2 Favored 'General case' 0 N--CA 1.47 0.539 0 O-C-N 120.871 -1.143 . . . . 0.0 111.653 165.365 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 16.4 m -133.09 161.36 41.69 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 C-N-CA 125.334 1.453 . . . . 0.0 109.959 163.18 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 43.8 tt0 -128.33 128.92 45.49 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 124.009 0.923 . . . . 0.0 111.875 174.841 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 527' ' ' ALA . . . . . 0.545 ' HA ' HG22 ' A' ' 589' ' ' THR . . . -62.83 123.52 18.69 Favored 'General case' 0 CA--C 1.538 0.484 0 O-C-N 121.547 -0.721 . . . . 0.0 111.576 -178.584 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 42.3 mm-40 -87.24 -32.96 19.48 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 124.785 1.234 . . . . 0.0 110.044 168.888 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 97.6 m-70 -130.54 153.66 48.62 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 126.54 1.936 . . . . 0.0 110.798 179.039 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -79.42 141.6 36.69 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 125.276 1.43 . . . . 0.0 113.182 176.566 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 86.4 t80 -134.0 128.2 33.88 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 115.397 1.629 . . . . 0.0 115.397 -174.974 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -92.9 112.13 23.98 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 116.268 1.951 . . . . 0.0 116.268 177.983 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -67.7 130.69 43.78 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 123.835 0.854 . . . . 0.0 111.026 171.81 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 534' ' ' THR . . . . . . . . . . . . 0.259 12.1 t -136.39 31.23 2.89 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 125.946 1.698 . . . . 0.0 112.694 179.739 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 41.1 t0 -146.66 169.99 17.87 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 125.086 1.354 . . . . 0.0 109.056 167.364 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 1.1 t -67.6 -26.77 66.43 Favored 'General case' 0 N--CA 1.47 0.536 0 N-CA-C 115.871 1.804 . . . . 0.0 115.871 168.048 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 35.6 t0 -76.51 -27.71 56.13 Favored 'General case' 0 CA--C 1.547 0.852 0 O-C-N 121.069 -1.02 . . . . 0.0 110.887 178.363 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 60.3 mt-10 -80.76 149.29 29.71 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 115.404 1.631 . . . . 0.0 115.404 -164.596 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -101.62 137.88 39.35 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 128.967 2.907 . . . . 0.0 109.866 174.506 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 19.9 tt0 -95.47 134.95 37.73 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 123.994 0.917 . . . . 0.0 111.064 175.892 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 80.1 mt -125.68 148.1 49.13 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.388 1.075 . . . . 0.0 112.647 -178.189 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 3.1 tppp? -113.57 141.31 47.33 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 126.85 2.06 . . . . 0.0 109.497 164.491 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -52.47 114.02 1.24 Allowed 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 119.025 0.829 . . . . 0.0 110.982 173.575 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 115.61 -15.41 17.18 Favored Glycine 0 CA--C 1.529 0.936 0 C-N-CA 126.024 1.773 . . . . 0.0 113.463 -173.161 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 78.3 m-20 -66.83 118.63 10.61 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 118.953 1.377 . . . . 0.0 113.873 -178.037 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 45.9 t -72.53 134.75 29.22 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 166.791 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -127.49 123.08 60.82 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.386 0 C-N-CA 125.856 1.662 . . . . 0.0 111.184 175.86 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 548' ' ' LEU . . . . . 0.562 HD23 ' HG2' ' A' ' 524' ' ' LYS . 22.3 mt -81.39 98.84 8.39 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.894 1.278 . . . . 0.0 108.393 178.438 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 549' ' ' VAL . . . . . 0.442 HG21 ' CE1' ' A' ' 523' ' ' PHE . 3.4 t -62.43 131.97 27.98 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.236 0 N-CA-C 114.772 1.397 . . . . 0.0 114.772 175.812 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 18.2 pt -133.24 158.24 76.23 Favored Pre-proline 0 CA--C 1.551 1.011 0 C-N-CA 127.134 2.173 . . . . 0.0 109.935 177.859 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 82.8 Cg_endo -71.16 154.51 62.01 Favored 'Trans proline' 0 CA--C 1.537 0.626 0 C-N-CA 124.031 3.154 . . . . 0.0 112.016 174.639 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 24.5 m-85 . . . . . 0 CA--C 1.538 0.486 0 N-CA-C 116.747 2.129 . . . . 0.0 116.747 -174.728 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 42.7 tt0 . . . . . 0 N--CA 1.469 0.49 0 N-CA-C 113.053 0.76 . . . . 0.0 113.053 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 50.6 m-20 -90.84 128.65 36.81 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 126.012 1.725 . . . . 0.0 110.886 -179.246 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 6.0 tm-20 -65.04 135.1 55.19 Favored 'General case' 0 N--CA 1.475 0.814 0 O-C-N 120.358 -1.464 . . . . 0.0 111.608 -178.701 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 80.51 -5.72 63.42 Favored Glycine 0 CA--C 1.538 1.524 0 C-N-CA 124.25 0.928 . . . . 0.0 115.229 -174.651 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 48.0 m95 -93.95 167.15 11.79 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 125.199 1.4 . . . . 0.0 112.87 172.846 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 16.8 mt -134.36 160.15 38.83 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 124.49 1.116 . . . . 0.0 110.328 165.177 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 38.1 ttm -114.77 143.45 45.06 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 124.976 1.31 . . . . 0.0 111.307 175.503 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -170.58 -172.5 36.99 Favored Glycine 0 CA--C 1.523 0.586 0 CA-C-O 121.687 0.604 . . . . 0.0 113.304 176.288 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 14.5 p -132.54 136.91 55.29 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 C-N-CA 125.595 1.558 . . . . 0.0 109.214 173.226 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 40.4 mtmt -62.86 137.85 58.38 Favored 'General case' 0 N--CA 1.465 0.318 0 O-C-N 121.085 -1.009 . . . . 0.0 111.805 178.758 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 71.2 tt0 -58.04 -44.89 87.64 Favored 'General case' 0 C--O 1.222 -0.356 0 CA-C-O 118.268 -0.872 . . . . 0.0 110.866 -178.15 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 10.5 t -63.92 -26.5 68.62 Favored 'General case' 0 CA--C 1.546 0.79 0 CA-C-N 119.735 1.152 . . . . 0.0 112.983 -177.427 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -72.84 -48.23 39.49 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 126.69 1.996 . . . . 0.0 109.452 175.951 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 64.6 t-105 -67.64 -30.3 69.82 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.443 1.497 . . . . 0.0 113.003 176.154 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 33.8 t-20 -76.17 -25.68 55.48 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 127.009 2.124 . . . . 0.0 112.202 175.869 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 32.0 mt-30 -80.1 3.22 21.12 Favored 'General case' 0 CA--C 1.546 0.797 0 N-CA-C 113.375 0.88 . . . . 0.0 113.375 160.351 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 95.0 m-70 54.38 34.43 20.73 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 126.241 1.816 . . . . 0.0 114.491 175.697 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 5.6 mtpm? -75.05 158.17 33.61 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 125.289 1.436 . . . . 0.0 111.758 178.092 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 8.1 pm0 -53.18 108.83 0.36 Allowed 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.738 1.615 . . . . 0.0 114.37 -176.707 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 64.0 tp -57.0 -47.29 81.19 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 125.197 1.399 . . . . 0.0 112.945 -170.041 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 56.6 mt-10 -68.13 -24.07 64.97 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 114.488 1.292 . . . . 0.0 114.488 -174.852 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 43.1 mmtm -85.52 -47.05 10.27 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 123.618 0.767 . . . . 0.0 111.816 168.692 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 89.5 m -67.45 -28.53 67.96 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 114.381 1.252 . . . . 0.0 114.381 -172.13 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 36.2 ptt180 -64.63 163.27 14.07 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 124.635 1.174 . . . . 0.0 113.505 175.428 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -171.63 172.9 44.85 Favored Glycine 0 CA--C 1.531 1.057 0 C-N-CA 125.092 1.33 . . . . 0.0 114.27 174.449 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 14.7 m -91.67 143.97 10.2 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.61 0 C-N-CA 125.522 1.529 . . . . 0.0 112.639 170.847 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 49.3 p90 -142.25 155.59 64.69 Favored Pre-proline 0 CA--C 1.545 0.778 0 C-N-CA 124.876 1.27 . . . . 0.0 112.91 176.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_endo -69.08 110.3 2.38 Favored 'Trans proline' 0 C--N 1.348 0.548 0 C-N-CA 122.453 2.102 . . . . 0.0 109.973 171.651 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -57.3 -25.1 58.76 Favored 'General case' 0 N--CA 1.474 0.761 0 O-C-N 121.311 -0.868 . . . . 0.0 113.273 -179.364 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 8.7 p-10 -70.24 -9.51 56.1 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.33 1.452 . . . . 0.0 114.464 176.726 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 18.6 m-85 -80.22 -12.64 59.61 Favored 'General case' 0 CA--C 1.539 0.539 0 N-CA-C 116.668 2.099 . . . . 0.0 116.668 164.949 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 589' ' ' THR . . . . . 0.545 HG22 ' HA ' ' A' ' 527' ' ' ALA . 39.4 p -127.26 176.87 7.08 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 125.543 1.537 . . . . 0.0 110.591 -170.727 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 16.7 pt-20 -134.67 147.98 50.25 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 124.96 1.304 . . . . 0.0 110.747 173.085 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 2.7 tmm_? -60.21 136.85 58.15 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 124.631 1.173 . . . . 0.0 112.812 173.054 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 592' ' ' VAL . . . . . 0.476 HG23 ' CB ' ' A' ' 524' ' ' LYS . 1.1 m . . . . . 0 CA--C 1.549 0.909 0 C-N-CA 126.752 2.021 . . . . 0.0 109.302 177.099 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo . . . . . 0 CA--C 1.544 0.988 0 CA-C-O 122.034 0.764 . . . . 0.0 114.065 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 7.7 p -139.82 136.27 38.98 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 C-N-CA 125.3 1.44 . . . . 0.0 111.815 179.634 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -70.24 141.76 89.09 Favored Pre-proline 0 CA--C 1.553 1.081 0 O-C-N 121.496 -0.752 . . . . 0.0 112.915 -176.276 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -74.37 163.88 35.3 Favored 'Trans proline' 0 CA--C 1.543 0.93 0 C-N-CA 122.804 2.336 . . . . 0.0 111.947 174.329 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo . . . . . 0 CA--C 1.541 0.862 0 C-N-CA 122.581 2.187 . . . . 0.0 112.116 179.396 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 517' ' ' LEU . . . . . 0.472 HD22 HD22 ' A' ' 548' ' ' LEU . 18.0 mt . . . . . 0 CA--C 1.547 0.832 0 N-CA-C 113.731 1.012 . . . . 0.0 113.731 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 34.8 Cg_endo -67.3 161.07 44.72 Favored 'Trans proline' 0 CA--C 1.54 0.805 0 C-N-CA 124.296 3.331 . . . . 0.0 114.298 -173.72 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -63.87 128.26 21.54 Favored 'Trans proline' 0 C--N 1.35 0.616 0 C-N-CA 123.065 2.51 . . . . 0.0 110.414 -178.623 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 75.34 3.9 72.26 Favored Glycine 0 CA--C 1.534 1.221 0 CA-C-O 117.425 -1.764 . . . . 0.0 115.367 -177.246 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 31.7 t80 -36.17 132.19 0.56 Allowed 'General case' 0 CA--C 1.545 0.763 0 N-CA-C 117.387 2.366 . . . . 0.0 117.387 177.168 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 38.0 mtm -100.06 -56.55 2.34 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 123.848 0.859 . . . . 0.0 112.437 -177.195 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 523' ' ' PHE . . . . . . . . . . . . . 28.6 p90 -167.06 168.18 13.93 Favored 'General case' 0 C--O 1.225 -0.229 0 C-N-CA 127.44 2.296 . . . . 0.0 112.245 -172.279 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 524' ' ' LYS . . . . . 0.547 ' HB2' HG23 ' A' ' 592' ' ' VAL . 82.2 mttt -103.1 163.61 12.12 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 121.135 -0.978 . . . . 0.0 111.356 171.331 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 12.0 m -134.26 160.5 41.62 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.813 0 C-N-CA 126.889 2.076 . . . . 0.0 109.331 165.268 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 48.0 tt0 -124.06 128.26 49.07 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-N 119.618 1.099 . . . . 0.0 112.324 170.236 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 527' ' ' ALA . . . . . 0.479 ' HA ' HG22 ' A' ' 589' ' ' THR . . . -60.62 123.91 18.83 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 124.401 1.081 . . . . 0.0 111.105 178.049 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 76.5 mm-40 -85.39 -37.6 19.68 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 125.448 1.499 . . . . 0.0 111.104 171.103 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 81.3 m-70 -127.63 155.59 43.65 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 127.025 2.13 . . . . 0.0 109.438 176.624 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -82.19 151.29 26.96 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 107.41 -1.33 . . . . 0.0 107.41 178.387 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 94.1 t80 -137.88 113.82 9.89 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 125.099 1.36 . . . . 0.0 113.288 -178.609 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 2.0 m -86.36 118.89 26.09 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 124.405 1.082 . . . . 0.0 113.45 172.696 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -70.22 146.58 50.6 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 124.896 1.278 . . . . 0.0 113.077 -179.864 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 14.5 t -102.01 -31.78 10.48 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 125.314 1.446 . . . . 0.0 113.381 171.111 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 87.2 m-20 -108.08 155.32 20.52 Favored 'General case' 0 N--CA 1.47 0.544 0 N-CA-C 116.808 2.151 . . . . 0.0 116.808 -172.389 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 4.3 t -65.91 -13.3 59.43 Favored 'General case' 0 N--CA 1.483 1.198 0 N-CA-C 116.51 2.041 . . . . 0.0 116.51 -178.547 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . 0.298 63.6 m-20 -113.75 2.53 15.21 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 117.114 2.265 . . . . 0.0 117.114 167.6 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 53.0 mt-10 -74.22 142.84 45.34 Favored 'General case' 0 CA--C 1.541 0.619 0 O-C-N 120.253 -1.53 . . . . 0.0 111.412 167.09 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -89.62 130.98 35.84 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 126.133 1.773 . . . . 0.0 109.643 176.21 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 14.7 tt0 -85.19 131.25 34.46 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 121.677 -0.639 . . . . 0.0 111.422 173.054 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 75.0 mt -121.11 151.1 40.26 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 124.423 1.089 . . . . 0.0 112.631 179.004 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 6.8 tmtt? -116.85 140.57 49.29 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 126.322 1.849 . . . . 0.0 109.753 169.496 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -53.9 106.6 0.2 Allowed 'General case' 0 CA--C 1.548 0.875 0 CA-C-N 119.12 0.873 . . . . 0.0 110.968 175.515 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 114.63 -6.84 22.44 Favored Glycine 0 CA--C 1.538 1.48 0 C-N-CA 125.518 1.533 . . . . 0.0 114.743 -172.943 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -65.5 118.97 10.22 Favored 'General case' 0 CA--C 1.519 -0.227 0 CA-C-N 119.503 1.651 . . . . 0.0 113.723 174.613 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 2.8 t -70.63 134.52 29.9 Favored 'Isoleucine or valine' 0 C--O 1.236 0.352 0 C-N-CA 120.656 -0.418 . . . . 0.0 110.252 159.208 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 1.1 t -123.32 124.47 69.94 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 C-N-CA 125.612 1.565 . . . . 0.0 110.93 175.388 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 548' ' ' LEU . . . . . 0.472 HD22 HD22 ' A' ' 517' ' ' LEU . 22.2 mt -83.75 99.15 10.08 Favored 'General case' 0 C--N 1.324 -0.541 0 C-N-CA 124.56 1.144 . . . . 0.0 108.216 179.293 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 549' ' ' VAL . . . . . . . . . . . . . 4.1 t -61.57 129.56 24.66 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.109 0 N-CA-C 114.052 1.131 . . . . 0.0 114.052 174.545 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 10.5 pt -124.18 153.73 68.38 Favored Pre-proline 0 CA--C 1.548 0.874 0 C-N-CA 126.44 1.896 . . . . 0.0 110.723 178.233 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -71.17 135.46 27.17 Favored 'Trans proline' 0 CA--C 1.534 0.508 0 C-N-CA 123.91 3.074 . . . . 0.0 111.296 178.56 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 552' ' ' PHE . . . . . 0.443 ' CE1' ' HA ' ' A' ' 558' ' ' GLN . 23.9 m-85 . . . . . 0 CA--C 1.534 0.341 0 N-CA-C 117.664 2.468 . . . . 0.0 117.664 -174.963 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 558' ' ' GLN . . . . . 0.443 ' HA ' ' CE1' ' A' ' 552' ' ' PHE . 40.0 tp60 . . . . . 0 N--CA 1.47 0.529 0 CA-C-O 122.154 0.978 . . . . 0.0 111.853 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . 0.256 6.6 m-20 -141.16 150.66 43.05 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 126.485 1.914 . . . . 0.0 114.525 174.661 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 51.3 tp10 -75.23 127.5 33.33 Favored 'General case' 0 N--CA 1.472 0.64 0 O-C-N 121.013 -1.054 . . . . 0.0 111.06 -173.492 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 82.18 -7.26 64.33 Favored Glycine 0 CA--C 1.538 1.518 0 C-N-CA 124.484 1.04 . . . . 0.0 114.255 -168.874 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 60.8 m95 -98.41 155.57 17.17 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.851 1.261 . . . . 0.0 112.897 178.927 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 6.8 mt -143.55 152.49 41.5 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 125.201 1.401 . . . . 0.0 110.493 176.475 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 55.7 ttm -110.45 140.28 44.85 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 124.275 1.03 . . . . 0.0 112.359 -179.587 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -172.69 -171.69 37.71 Favored Glycine 0 CA--C 1.524 0.641 0 C-N-CA 123.92 0.772 . . . . 0.0 113.237 -179.284 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 11.6 p -131.87 143.2 40.94 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.53 0 C-N-CA 125.131 1.372 . . . . 0.0 110.506 172.375 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 42.0 mtmt -57.94 131.49 50.58 Favored 'General case' 0 N--CA 1.467 0.397 0 O-C-N 121.615 -0.678 . . . . 0.0 111.704 175.08 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -62.49 -40.59 97.19 Favored 'General case' 0 C--O 1.223 -0.325 0 CA-C-O 118.281 -0.866 . . . . 0.0 110.548 176.543 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 26.6 t -58.74 -32.33 69.13 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 119.559 1.072 . . . . 0.0 112.291 177.003 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -76.77 -45.72 27.94 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 114.98 1.474 . . . . 0.0 114.98 177.038 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 56.2 t-105 -67.28 -39.15 85.97 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.85 1.26 . . . . 0.0 112.957 176.492 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 5.0 t-20 -64.17 -28.71 69.94 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 124.894 1.278 . . . . 0.0 111.201 176.061 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 39.4 mt-30 -92.0 7.17 43.42 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.429 1.492 . . . . 0.0 114.614 171.991 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 89.0 m-70 56.48 34.74 24.83 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 126.432 1.893 . . . . 0.0 114.449 176.508 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 62.2 mttt -73.78 155.77 38.51 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.452 1.101 . . . . 0.0 111.614 174.553 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 12.8 pm0 -57.03 102.93 0.09 Allowed 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 115.403 1.631 . . . . 0.0 115.403 -170.413 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 47.5 tp -53.0 -45.91 68.09 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 125.097 1.359 . . . . 0.0 112.165 -176.697 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 19.5 pt-20 -63.21 -16.14 59.24 Favored 'General case' 0 N--CA 1.479 0.999 0 N-CA-C 115.202 1.556 . . . . 0.0 115.202 -176.889 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 29.0 tptp -114.57 -37.0 4.4 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 125.927 1.691 . . . . 0.0 112.345 -178.987 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 47.9 t -70.23 -30.57 67.67 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.217 1.407 . . . . 0.0 112.885 176.965 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 30.9 ptt85 -60.58 158.64 12.0 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 124.174 0.989 . . . . 0.0 112.839 176.701 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -179.25 175.91 47.47 Favored Glycine 0 N--CA 1.461 0.337 0 CA-C-N 115.966 -0.561 . . . . 0.0 114.375 173.111 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 34.7 m -88.52 140.19 16.19 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 C-N-CA 124.317 1.047 . . . . 0.0 111.149 167.719 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 43.3 p90 -134.44 155.25 79.88 Favored Pre-proline 0 CA--C 1.538 0.503 0 C-N-CA 125.159 1.383 . . . . 0.0 112.565 173.552 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -66.31 113.58 2.72 Favored 'Trans proline' 0 CA--C 1.536 0.617 0 C-N-CA 122.427 2.085 . . . . 0.0 110.451 171.307 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 15.6 pt-20 -60.28 -26.09 66.22 Favored 'General case' 0 N--CA 1.475 0.786 0 O-C-N 121.108 -0.995 . . . . 0.0 112.03 -178.01 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 13.8 p-10 -71.37 -9.21 57.78 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 126.99 2.116 . . . . 0.0 114.444 177.005 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 14.0 m-85 -81.16 -14.09 57.98 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 116.714 2.116 . . . . 0.0 116.714 163.446 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 589' ' ' THR . . . . . 0.479 HG22 ' HA ' ' A' ' 527' ' ' ALA . 54.7 p -126.61 168.85 13.75 Favored 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 125.106 1.362 . . . . 0.0 110.453 -172.766 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -120.66 141.65 50.18 Favored 'General case' 0 N--CA 1.465 0.289 0 C-N-CA 123.489 0.716 . . . . 0.0 109.857 173.912 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.06 130.13 42.24 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 124.412 1.085 . . . . 0.0 109.157 174.732 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 592' ' ' VAL . . . . . 0.547 HG23 ' HB2' ' A' ' 524' ' ' LYS . 4.7 m . . . . . 0 N--CA 1.477 0.92 0 C-N-CA 125.186 1.394 . . . . 0.0 108.938 179.446 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 92.9 Cg_endo . . . . . 0 CA--C 1.54 0.805 0 CA-C-O 121.368 0.487 . . . . 0.0 112.186 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 51.8 t -137.17 134.0 47.35 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 C-N-CA 125.461 1.504 . . . . 0.0 110.313 177.479 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -68.14 133.0 91.7 Favored Pre-proline 0 CA--C 1.547 0.849 0 CA-C-O 118.237 -0.887 . . . . 0.0 111.608 -175.23 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 3.2 Cg_exo -65.07 166.49 18.56 Favored 'Trans proline' 0 CA--C 1.541 0.839 0 C-N-CA 122.69 2.26 . . . . 0.0 113.221 -178.611 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 36.9 Cg_exo . . . . . 0 CA--C 1.54 0.778 0 C-N-CA 122.998 2.465 . . . . 0.0 112.364 162.688 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 517' ' ' LEU . . . . . 0.447 HD22 HD22 ' A' ' 548' ' ' LEU . 12.8 mt . . . . . 0 CA--C 1.544 0.732 0 N-CA-C 113.32 0.859 . . . . 0.0 113.32 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_endo -67.71 160.82 46.49 Favored 'Trans proline' 0 CA--C 1.543 0.97 0 C-N-CA 124.304 3.336 . . . . 0.0 114.622 -172.875 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 66.2 Cg_endo -64.07 133.53 38.77 Favored 'Trans proline' 0 C--N 1.349 0.558 0 C-N-CA 123.267 2.645 . . . . 0.0 110.488 177.56 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 73.8 0.61 55.99 Favored Glycine 0 CA--C 1.535 1.292 0 CA-C-O 117.36 -1.8 . . . . 0.0 115.386 -175.785 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 38.7 t80 -36.59 123.31 0.81 Allowed 'General case' 0 C--N 1.349 0.582 0 CA-C-N 120.717 2.258 . . . . 0.0 116.634 179.823 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 50.1 mtm -94.98 -54.2 3.54 Favored 'General case' 0 N--CA 1.465 0.316 0 C-N-CA 123.252 0.621 . . . . 0.0 111.28 -177.206 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 523' ' ' PHE . . . . . . . . . . . . . 24.9 p90 -167.96 167.16 12.93 Favored 'General case' 0 C--O 1.223 -0.314 0 C-N-CA 126.646 1.978 . . . . 0.0 113.085 -172.685 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 524' ' ' LYS . . . . . 0.583 ' HB2' HG23 ' A' ' 592' ' ' VAL . 80.6 mttt -100.26 161.74 13.41 Favored 'General case' 0 C--N 1.326 -0.433 0 O-C-N 121.3 -0.875 . . . . 0.0 111.039 167.616 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 18.0 m -136.86 154.88 32.27 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 C-N-CA 126.742 2.017 . . . . 0.0 108.794 167.833 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 44.6 tt0 -118.68 129.13 55.12 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 119.698 1.135 . . . . 0.0 111.261 173.063 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 527' ' ' ALA . . . . . 0.504 ' HA ' HG22 ' A' ' 589' ' ' THR . . . -62.72 119.32 9.06 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 124.028 0.931 . . . . 0.0 112.181 -178.444 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 44.7 mm-40 -85.79 -15.31 42.44 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 125.734 1.614 . . . . 0.0 111.932 173.958 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 92.3 m-70 -147.75 156.87 43.2 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 126.067 1.747 . . . . 0.0 111.369 -172.512 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -81.91 124.22 29.54 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 125.416 1.486 . . . . 0.0 114.646 175.957 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 88.4 t80 -129.87 114.56 16.04 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 124.68 1.192 . . . . 0.0 112.333 -177.426 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -83.04 125.63 31.67 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 124.341 1.056 . . . . 0.0 113.425 171.856 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -64.39 137.58 57.97 Favored 'General case' 0 CA--C 1.537 0.474 0 O-C-N 121.293 -0.879 . . . . 0.0 110.48 175.708 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 534' ' ' THR . . . . . . . . . . . . 0.272 2.0 t -132.35 3.53 3.94 Favored 'General case' 0 N--CA 1.473 0.722 0 N-CA-C 115.501 1.667 . . . . 0.0 115.501 -173.211 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -136.09 159.43 41.75 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 126.834 2.054 . . . . 0.0 115.1 165.509 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 1.2 t -61.76 -12.18 15.76 Favored 'General case' 0 N--CA 1.476 0.833 0 N-CA-C 117.143 2.275 . . . . 0.0 117.143 -172.563 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 17.5 p30 -111.91 -0.79 15.69 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 127.716 2.406 . . . . 0.0 116.366 177.866 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 76.7 mt-10 -81.47 144.11 31.59 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 114.437 1.273 . . . . 0.0 114.437 -175.634 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -84.86 152.23 23.73 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 125.825 1.65 . . . . 0.0 109.945 171.133 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -119.3 128.21 53.93 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 125.101 1.36 . . . . 0.0 110.541 -176.734 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 74.4 mt -128.07 146.72 50.6 Favored 'General case' 0 N--CA 1.471 0.575 0 C-N-CA 124.761 1.224 . . . . 0.0 112.25 -168.935 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -120.35 143.46 48.38 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 126.86 2.064 . . . . 0.0 109.404 173.232 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -55.77 99.69 0.03 OUTLIER 'General case' 0 CA--C 1.552 1.021 0 CA-C-N 119.619 1.099 . . . . 0.0 112.533 178.889 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 125.99 -7.22 7.73 Favored Glycine 0 CA--C 1.537 1.461 0 C-N-CA 126.545 2.021 . . . . 0.0 115.174 -173.728 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 80.4 m-20 -73.04 121.75 20.65 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-N 120.18 1.99 . . . . 0.0 114.223 -177.609 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 4.1 t -73.36 133.99 30.6 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 CA-C-N 119.386 0.994 . . . . 0.0 111.373 165.306 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 1.4 t -119.74 124.63 73.19 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.516 0 C-N-CA 126.173 1.789 . . . . 0.0 111.048 172.492 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 548' ' ' LEU . . . . . 0.451 ' CD2' ' HE2' ' A' ' 524' ' ' LYS . 22.5 mt -80.28 98.63 7.49 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 174.637 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 549' ' ' VAL . . . . . . . . . . . . . 4.1 t -62.95 130.4 27.52 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 N-CA-C 114.449 1.277 . . . . 0.0 114.449 174.283 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 20.9 pt -127.3 157.65 71.9 Favored Pre-proline 0 CA--C 1.546 0.805 0 C-N-CA 127.034 2.134 . . . . 0.0 109.838 177.73 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo -71.05 154.27 62.64 Favored 'Trans proline' 0 CA--C 1.54 0.789 0 C-N-CA 123.358 2.705 . . . . 0.0 112.431 174.565 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 43.5 m-85 . . . . . 0 CA--C 1.537 0.463 0 N-CA-C 116.855 2.168 . . . . 0.0 116.855 177.994 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 40.6 tt0 . . . . . 0 CA--C 1.544 0.738 0 N-CA-C 113.995 1.109 . . . . 0.0 113.995 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -85.49 131.28 34.4 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.175 1.39 . . . . 0.0 109.158 -177.867 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 73.6 tt0 -60.66 130.74 48.01 Favored 'General case' 0 N--CA 1.472 0.654 0 O-C-N 121.014 -1.054 . . . . 0.0 111.68 178.023 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 84.89 -12.02 58.45 Favored Glycine 0 CA--C 1.532 1.148 0 C-N-CA 124.833 1.206 . . . . 0.0 114.966 -178.7 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 48.6 m95 -91.48 155.48 18.39 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 124.664 1.186 . . . . 0.0 113.048 178.98 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 14.1 mt -126.76 151.94 47.54 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 124.038 0.935 . . . . 0.0 110.455 170.345 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 56.5 ttm -109.84 143.4 39.78 Favored 'General case' 0 N--CA 1.464 0.243 0 C-N-CA 124.179 0.992 . . . . 0.0 111.003 174.842 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -170.9 -172.9 37.61 Favored Glycine 0 CA--C 1.524 0.597 0 C-N-CA 123.888 0.756 . . . . 0.0 112.765 177.898 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 14.1 p -133.63 139.61 48.44 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.487 0 C-N-CA 125.232 1.413 . . . . 0.0 108.79 170.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 36.4 mtmt -58.49 136.68 57.58 Favored 'General case' 0 N--CA 1.467 0.418 0 O-C-N 121.215 -0.928 . . . . 0.0 111.16 175.71 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 19.6 tt0 -61.73 -40.74 96.17 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 118.281 -0.866 . . . . 0.0 110.876 179.436 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 34.3 m -61.38 -35.62 77.99 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 119.456 1.025 . . . . 0.0 112.663 176.48 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 67.1 m-20 -68.34 -46.62 69.66 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 125.742 1.617 . . . . 0.0 115.067 174.351 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 53.4 t-105 -66.94 -33.63 76.0 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 124.315 1.046 . . . . 0.0 112.242 174.532 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 4.2 t-20 -73.35 -23.7 60.25 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.273 1.429 . . . . 0.0 112.672 172.097 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 38.3 mt-30 -77.17 0.25 22.46 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 125.046 1.338 . . . . 0.0 113.399 168.279 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 91.9 m-70 62.18 31.71 17.55 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.442 1.497 . . . . 0.0 113.483 172.94 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 79.1 mttt -76.72 157.58 31.61 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 126.046 1.738 . . . . 0.0 112.083 177.176 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -62.23 113.47 2.9 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 124.348 1.059 . . . . 0.0 113.145 174.426 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 59.6 tp -56.32 -42.74 78.14 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.465 1.506 . . . . 0.0 112.046 -178.814 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 23.9 pt-20 -68.95 -8.36 43.79 Favored 'General case' 0 N--CA 1.477 0.88 0 N-CA-C 115.06 1.504 . . . . 0.0 115.06 -173.778 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 34.8 mmtp -111.72 -41.35 4.07 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 124.72 1.208 . . . . 0.0 111.778 166.78 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 96.6 m -76.49 -17.47 59.27 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 115.059 1.503 . . . . 0.0 115.059 -172.18 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 20.4 ptt180 -65.13 163.85 14.22 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 125.011 1.324 . . . . 0.0 112.629 169.279 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -167.11 174.18 42.36 Favored Glycine 0 CA--C 1.526 0.754 0 CA-C-N 114.734 -1.121 . . . . 0.0 113.985 169.542 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 31.5 m -93.55 140.83 15.74 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.594 0 C-N-CA 124.748 1.219 . . . . 0.0 110.705 168.333 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 40.9 p90 -138.02 156.54 74.03 Favored Pre-proline 0 CA--C 1.543 0.684 0 C-N-CA 124.274 1.03 . . . . 0.0 113.245 177.291 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -66.97 111.89 2.33 Favored 'Trans proline' 0 CA--C 1.535 0.571 0 C-N-CA 122.629 2.219 . . . . 0.0 110.169 170.015 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 22.1 pt-20 -56.22 -29.83 61.51 Favored 'General case' 0 N--CA 1.475 0.821 0 O-C-N 121.309 -0.87 . . . . 0.0 112.5 -178.72 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 13.0 p-10 -69.2 -14.14 62.8 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 127.019 2.127 . . . . 0.0 113.867 -179.587 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 18.8 m-85 -75.21 -8.86 57.78 Favored 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 116.952 2.205 . . . . 0.0 116.952 164.64 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 589' ' ' THR . . . . . 0.504 HG22 ' HA ' ' A' ' 527' ' ' ALA . 70.0 p -130.3 168.48 16.82 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 125.39 1.476 . . . . 0.0 111.827 -173.387 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -124.52 137.86 54.38 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 123.93 0.892 . . . . 0.0 109.791 173.422 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.93 137.85 56.36 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 124.712 1.205 . . . . 0.0 110.549 174.871 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 592' ' ' VAL . . . . . 0.583 HG23 ' HB2' ' A' ' 524' ' ' LYS . 2.7 m . . . . . 0 N--CA 1.48 1.029 0 C-N-CA 125.623 1.569 . . . . 0.0 109.601 178.322 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo . . . . . 0 CA--C 1.541 0.847 0 CA-C-O 122.173 0.822 . . . . 0.0 113.535 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 90.6 t -131.93 136.8 56.18 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.854 0 C-N-CA 126.559 1.944 . . . . 0.0 108.431 173.629 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -62.34 139.04 96.41 Favored Pre-proline 0 CA--C 1.547 0.864 0 O-C-N 121.78 -0.575 . . . . 0.0 111.952 -177.344 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -69.04 161.36 46.15 Favored 'Trans proline' 0 CA--C 1.539 0.738 0 C-N-CA 121.976 1.784 . . . . 0.0 110.587 177.995 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 46.9 Cg_exo . . . . . 0 N--CA 1.459 -0.51 0 C-N-CA 122.227 1.952 . . . . 0.0 111.95 176.194 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 517' ' ' LEU . . . . . 0.469 HD22 HD22 ' A' ' 548' ' ' LEU . 13.2 mt . . . . . 0 CA--C 1.543 0.676 0 N-CA-C 111.404 0.15 . . . . 0.0 111.404 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_endo -66.99 162.33 38.57 Favored 'Trans proline' 0 CA--C 1.538 0.718 0 C-N-CA 123.436 2.757 . . . . 0.0 114.776 -171.245 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -56.78 128.58 30.55 Favored 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 123.793 2.996 . . . . 0.0 111.077 176.536 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 73.9 2.26 61.04 Favored Glycine 0 CA--C 1.535 1.311 0 CA-C-O 116.956 -2.024 . . . . 0.0 116.384 -176.851 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 35.7 t80 -38.48 127.54 1.44 Allowed 'General case' 0 C--N 1.349 0.563 0 CA-C-N 121.053 2.427 . . . . 0.0 116.909 -175.741 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 48.8 mtm -104.25 -53.17 2.78 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 123.631 0.772 . . . . 0.0 112.116 -176.911 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 523' ' ' PHE . . . . . . . . . . . . . 25.6 p90 -166.58 172.29 10.86 Favored 'General case' 0 N--CA 1.465 0.322 0 C-N-CA 125.775 1.63 . . . . 0.0 113.181 -174.539 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 524' ' ' LYS . . . . . 0.542 ' HE2' ' CD2' ' A' ' 548' ' ' LEU . 78.3 mttt -104.52 164.8 11.49 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 121.214 -0.929 . . . . 0.0 112.446 170.369 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 14.6 m -133.85 161.92 40.22 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 126.686 1.995 . . . . 0.0 109.383 164.688 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 33.1 tt0 -125.44 130.01 50.98 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-N 118.929 0.786 . . . . 0.0 111.919 168.703 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 527' ' ' ALA . . . . . 0.475 ' HA ' HG22 ' A' ' 589' ' ' THR . . . -62.28 127.25 30.48 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.098 0.959 . . . . 0.0 111.518 178.613 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 40.1 mm-40 -88.66 -29.05 20.21 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 125.409 1.483 . . . . 0.0 110.813 170.634 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 97.5 m-70 -137.34 157.19 47.15 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 126.13 1.772 . . . . 0.0 111.518 -176.198 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 14.8 p-10 -83.12 131.6 35.13 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 114.908 1.447 . . . . 0.0 114.908 178.085 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 78.0 t80 -133.75 116.5 15.82 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.337 1.055 . . . . 0.0 112.356 -172.335 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 2.3 m -83.77 125.61 32.09 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 114.947 1.462 . . . . 0.0 114.947 176.657 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -71.67 142.49 49.88 Favored 'General case' 0 CA--C 1.538 0.508 0 O-C-N 121.459 -0.775 . . . . 0.0 111.702 172.634 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 2.9 t -138.44 -4.59 1.64 Allowed 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 126.476 1.91 . . . . 0.0 115.78 -175.845 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 19.6 m-20 -119.53 155.04 32.92 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 127.138 2.175 . . . . 0.0 116.018 164.082 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 5.6 t -55.75 -22.63 25.05 Favored 'General case' 0 N--CA 1.477 0.911 0 N-CA-C 116.62 2.081 . . . . 0.0 116.62 -179.628 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 70.1 m-20 -99.05 -8.14 25.75 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 115.622 1.712 . . . . 0.0 115.622 177.337 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 11.8 mt-10 -74.52 157.07 36.14 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 114.89 1.441 . . . . 0.0 114.89 -177.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -103.7 137.37 41.83 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 127.807 2.443 . . . . 0.0 111.147 173.808 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 33.4 tt0 -94.12 121.73 35.92 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.955 1.302 . . . . 0.0 111.512 176.443 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 71.2 mt -118.52 148.18 42.89 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.645 1.178 . . . . 0.0 113.076 -177.429 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 5.9 tppt? -112.25 145.04 40.65 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 127.245 2.218 . . . . 0.0 110.296 166.294 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -56.46 104.04 0.13 Allowed 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.694 0.798 . . . . 0.0 110.565 172.237 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 121.18 -9.45 10.24 Favored Glycine 0 CA--C 1.535 1.305 0 C-N-CA 125.925 1.726 . . . . 0.0 114.736 -173.183 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 88.7 m-20 -70.56 124.9 25.35 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 119.854 1.827 . . . . 0.0 114.945 -178.973 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 2.4 t -74.65 136.54 24.95 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 CA-C-N 118.313 0.506 . . . . 0.0 111.615 165.333 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 1.2 t -128.55 121.4 55.03 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 C-N-CA 124.69 1.196 . . . . 0.0 111.703 176.523 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 548' ' ' LEU . . . . . 0.542 ' CD2' ' HE2' ' A' ' 524' ' ' LYS . 17.2 mt -77.83 100.54 6.36 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.697 1.199 . . . . 0.0 108.533 175.792 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 549' ' ' VAL . . . . . . . . . . . . . 7.2 t -61.42 130.24 25.3 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.966 0 N-CA-C 113.945 1.091 . . . . 0.0 113.945 173.118 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 8.3 pt -127.61 156.76 74.91 Favored Pre-proline 0 CA--C 1.542 0.659 0 C-N-CA 126.443 1.897 . . . . 0.0 109.564 178.102 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 80.0 Cg_endo -70.78 154.19 63.85 Favored 'Trans proline' 0 CA--C 1.538 0.715 0 C-N-CA 123.016 2.477 . . . . 0.0 111.523 171.083 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 33.1 m-85 . . . . . 0 CA--C 1.542 0.649 0 N-CA-C 115.581 1.697 . . . . 0.0 115.581 172.02 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 38.4 tt0 . . . . . 0 CA--C 1.542 0.636 0 N-CA-C 113.184 0.809 . . . . 0.0 113.184 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -114.85 137.36 52.05 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 126.657 1.983 . . . . 0.0 113.757 -176.848 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 39.8 tp10 -74.39 133.95 42.45 Favored 'General case' 0 N--CA 1.474 0.744 0 O-C-N 120.406 -1.434 . . . . 0.0 112.664 -168.847 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 84.36 -8.1 69.43 Favored Glycine 0 CA--C 1.536 1.359 0 C-N-CA 125.412 1.482 . . . . 0.0 114.264 -173.4 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 60.2 m95 -92.58 161.41 14.6 Favored 'General case' 0 C--O 1.235 0.291 0 C-N-CA 125.389 1.476 . . . . 0.0 112.642 175.547 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 13.9 mt -132.99 152.15 51.99 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 124.815 1.246 . . . . 0.0 109.603 166.267 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 39.4 tpp -106.68 140.23 39.87 Favored 'General case' 0 N--CA 1.465 0.275 0 C-N-CA 124.46 1.104 . . . . 0.0 110.389 171.732 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -165.33 -172.72 33.1 Favored Glycine 0 CA--C 1.523 0.564 0 CA-C-O 122.191 0.884 . . . . 0.0 113.395 174.376 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 12.7 p -130.15 137.92 55.22 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.383 0 C-N-CA 125.386 1.474 . . . . 0.0 108.816 169.433 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 29.4 mtmt -56.82 134.19 54.99 Favored 'General case' 0 N--CA 1.465 0.303 0 O-C-N 121.406 -0.809 . . . . 0.0 110.917 175.49 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -61.41 -38.75 88.22 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-O 118.993 -0.527 . . . . 0.0 111.042 177.686 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 10.8 t -66.07 -35.0 79.36 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 119.439 1.018 . . . . 0.0 112.246 175.5 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 -59.15 -51.11 71.44 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 114.024 1.12 . . . . 0.0 114.024 168.53 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 61.9 t-105 -69.66 -32.54 71.24 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.685 1.594 . . . . 0.0 113.286 -178.817 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 12.3 t-20 -78.95 -18.38 53.86 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 125.315 1.446 . . . . 0.0 112.607 173.949 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 8.8 mm100 -90.08 5.26 47.49 Favored 'General case' 0 CA--C 1.546 0.822 0 CA-C-N 119.333 0.969 . . . . 0.0 113.514 163.509 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 83.8 m-70 61.85 25.81 15.56 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 126.367 1.867 . . . . 0.0 114.623 172.145 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 78.4 mttt -68.24 155.29 40.0 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 125.448 1.499 . . . . 0.0 111.489 177.28 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 6.9 pm0 -64.53 104.78 0.84 Allowed 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 114.295 1.22 . . . . 0.0 114.295 -169.133 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 56.1 tp -51.91 -45.06 64.09 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.348 1.059 . . . . 0.0 113.266 -173.961 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -66.28 -19.73 65.9 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 114.334 1.235 . . . . 0.0 114.334 -174.171 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 14.6 mmmm -100.37 -41.02 7.2 Favored 'General case' 0 N--CA 1.481 1.111 0 CA-C-N 119.104 0.865 . . . . 0.0 112.208 164.465 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 91.0 m -71.59 -23.61 61.76 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 114.979 1.474 . . . . 0.0 114.979 -169.733 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 38.0 ptt180 -62.38 166.03 5.47 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 125.097 1.359 . . . . 0.0 112.293 172.03 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -176.92 169.45 41.84 Favored Glycine 0 CA--C 1.522 0.509 0 N-CA-C 114.888 0.715 . . . . 0.0 114.888 172.583 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 31.6 m -86.06 145.71 7.42 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.213 0 C-N-CA 123.817 0.847 . . . . 0.0 110.872 170.909 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 47.8 p90 -142.96 155.07 62.62 Favored Pre-proline 0 CA--C 1.545 0.752 0 C-N-CA 125.426 1.49 . . . . 0.0 112.186 174.831 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -68.19 113.61 3.13 Favored 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.361 2.04 . . . . 0.0 109.703 171.441 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 20.2 pt-20 -58.6 -26.47 63.7 Favored 'General case' 0 N--CA 1.475 0.805 0 O-C-N 121.269 -0.894 . . . . 0.0 112.497 -177.668 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 9.0 p-10 -68.77 -16.2 63.73 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 126.503 1.921 . . . . 0.0 114.435 176.73 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 19.0 m-85 -72.78 -14.1 61.46 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 116.749 2.129 . . . . 0.0 116.749 162.008 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 589' ' ' THR . . . . . 0.475 HG22 ' HA ' ' A' ' 527' ' ' ALA . 64.1 p -124.27 177.27 5.94 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 126.173 1.789 . . . . 0.0 110.957 -176.261 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 16.8 pt-20 -131.62 138.57 48.85 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.511 0.724 . . . . 0.0 110.368 170.35 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -70.85 111.75 6.51 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 125.465 1.506 . . . . 0.0 109.849 -177.511 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 592' ' ' VAL . . . . . 0.471 HG23 ' HB2' ' A' ' 524' ' ' LYS . 2.6 m . . . . . 0 N--CA 1.479 1.014 0 C-N-CA 124.78 1.232 . . . . 0.0 109.428 -178.688 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 39.0 Cg_endo . . . . . 0 CA--C 1.536 0.585 0 N-CA-C 113.651 0.597 . . . . 0.0 113.651 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 19.9 t -132.64 125.36 52.85 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 125.337 1.455 . . . . 0.0 111.445 -178.324 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -66.04 141.11 97.33 Favored Pre-proline 0 CA--C 1.547 0.853 0 C-N-CA 123.639 0.776 . . . . 0.0 113.035 -174.443 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -72.7 167.17 27.88 Favored 'Trans proline' 0 CA--C 1.547 1.149 0 C-N-CA 122.415 2.076 . . . . 0.0 112.579 175.557 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo . . . . . 0 CA--C 1.536 0.608 0 C-N-CA 123.097 2.531 . . . . 0.0 113.244 174.495 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 513' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.963 0 N-CA-C 111.521 -0.632 . . . . 0.0 111.521 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 514' ' ' ARG . . . . . . . . . . . . . 10.1 mmt180 -102.42 151.71 21.97 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 125.832 1.653 . . . . 0.0 113.805 -174.422 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 39.3 tp -115.95 -18.31 10.73 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 124.548 1.139 . . . . 0.0 113.015 176.639 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 516' ' ' ASP . . . . . . . . . . . . 0.286 6.9 p-10 -80.25 118.41 21.89 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 123.878 0.871 . . . . 0.0 113.343 152.364 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 517' ' ' LEU . . . . . 0.492 HD22 HD22 ' A' ' 548' ' ' LEU . 14.1 mt -129.55 164.65 38.39 Favored Pre-proline 0 CA--C 1.543 0.703 0 C-N-CA 125.234 1.413 . . . . 0.0 112.23 -153.627 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -66.5 160.53 45.38 Favored 'Trans proline' 0 CA--C 1.537 0.631 0 C-N-CA 123.408 2.739 . . . . 0.0 113.401 -174.46 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 44.6 Cg_endo -59.05 133.15 51.43 Favored 'Trans proline' 0 N--CA 1.458 -0.564 0 C-N-CA 123.155 2.57 . . . . 0.0 110.656 -177.918 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 70.57 2.45 43.41 Favored Glycine 0 CA--C 1.537 1.451 0 CA-C-O 117.422 -1.765 . . . . 0.0 116.378 -178.803 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 19.6 t80 -34.6 131.61 0.34 Allowed 'General case' 0 CA--C 1.543 0.711 0 N-CA-C 117.76 2.504 . . . . 0.0 117.76 179.733 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 52.8 mtm -100.38 -57.02 2.21 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 -176.379 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 523' ' ' PHE . . . . . 0.481 ' CE1' HG21 ' A' ' 549' ' ' VAL . 32.7 p90 -167.58 173.7 8.38 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 127.963 2.505 . . . . 0.0 110.848 -176.093 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 524' ' ' LYS . . . . . 0.507 ' HE2' ' CD2' ' A' ' 548' ' ' LEU . 85.3 mttt -106.34 160.31 15.47 Favored 'General case' 0 N--CA 1.47 0.558 0 O-C-N 121.212 -0.93 . . . . 0.0 111.22 172.358 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 15.5 m -130.24 161.28 40.3 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 C-N-CA 126.184 1.794 . . . . 0.0 109.39 165.377 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 26.9 tt0 -127.41 128.83 46.46 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 119.541 1.064 . . . . 0.0 111.803 172.001 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 527' ' ' ALA . . . . . 0.407 ' HA ' HG22 ' A' ' 589' ' ' THR . . . -60.99 127.98 34.2 Favored 'General case' 0 CA--C 1.538 0.494 0 O-C-N 121.188 -0.945 . . . . 0.0 111.288 179.566 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 29.3 mm-40 -94.43 -25.75 16.78 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.49 1.516 . . . . 0.0 111.237 173.261 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 77.3 m-70 -135.66 162.9 31.43 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 127.444 2.298 . . . . 0.0 109.367 -178.652 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -90.51 143.31 26.87 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 121.117 -0.989 . . . . 0.0 113.29 177.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 89.6 t80 -136.25 125.29 24.37 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.978 1.311 . . . . 0.0 114.054 -177.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 3.5 m -96.92 120.64 37.64 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 113.785 1.032 . . . . 0.0 113.785 174.107 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -65.54 116.94 7.32 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-O 121.541 0.686 . . . . 0.0 111.901 -176.952 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 13.1 t -81.46 -28.54 34.11 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 123.897 0.879 . . . . 0.0 113.27 -173.82 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -140.36 176.72 8.54 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 116.268 1.951 . . . . 0.0 116.268 -165.343 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 536' ' ' THR . . . . . . . . . . . . 0.305 0.6 OUTLIER -75.84 -5.53 46.42 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 118.86 2.911 . . . . 0.0 118.86 -162.333 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . 0.389 1.6 p-10 -110.39 -10.22 14.59 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 115.832 1.79 . . . . 0.0 115.832 165.787 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 30.4 mp0 -80.4 145.2 32.11 Favored 'General case' 0 CA--C 1.557 1.238 0 N-CA-C 114.798 1.407 . . . . 0.0 114.798 -167.777 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -97.76 138.35 35.25 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 129.303 3.041 . . . . 0.0 110.699 -177.561 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 20.4 tt0 -90.49 135.0 33.97 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 123.958 0.903 . . . . 0.0 112.354 175.032 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 80.0 mt -126.75 145.75 50.49 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 125.159 1.384 . . . . 0.0 112.469 -179.691 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 9.9 tmtt? -112.32 141.2 46.33 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 125.34 1.456 . . . . 0.0 108.803 167.362 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -52.11 109.84 0.42 Allowed 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 118.888 0.767 . . . . 0.0 110.748 174.179 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 115.9 -8.81 18.91 Favored Glycine 0 CA--C 1.535 1.295 0 C-N-CA 125.797 1.665 . . . . 0.0 114.807 -174.651 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 64.5 m-20 -72.47 121.11 19.04 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 119.959 1.88 . . . . 0.0 114.279 -179.48 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 6.5 t -71.48 135.52 27.77 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 CA-C-N 118.688 0.676 . . . . 0.0 110.404 164.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -123.53 123.77 68.11 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.489 0 C-N-CA 125.813 1.645 . . . . 0.0 110.828 174.839 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 548' ' ' LEU . . . . . 0.507 ' CD2' ' HE2' ' A' ' 524' ' ' LYS . 21.6 mt -81.11 100.63 9.14 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 108.118 -1.067 . . . . 0.0 108.118 179.148 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 549' ' ' VAL . . . . . 0.481 HG21 ' CE1' ' A' ' 523' ' ' PHE . 5.7 t -60.43 130.02 23.72 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.166 0 N-CA-C 113.811 1.041 . . . . 0.0 113.811 174.31 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 10.2 pt -127.37 157.47 72.6 Favored Pre-proline 0 CA--C 1.549 0.936 0 C-N-CA 126.77 2.028 . . . . 0.0 110.514 177.263 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_endo -74.58 151.28 41.56 Favored 'Trans proline' 0 CA--C 1.54 0.812 0 C-N-CA 123.813 3.009 . . . . 0.0 111.729 172.402 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 552' ' ' PHE . . . . . 0.403 ' CE2' ' HA ' ' A' ' 558' ' ' GLN . 42.0 m-85 -69.04 155.7 39.91 Favored 'General case' 0 CA--C 1.539 0.523 0 N-CA-C 118.013 2.597 . . . . 0.0 118.013 -177.379 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 553' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 -75.67 -15.19 60.35 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 114.554 1.316 . . . . 0.0 114.554 171.413 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -159.38 152.16 18.04 Favored Pre-proline 0 CA--C 1.547 0.847 0 C-N-CA 125.861 1.664 . . . . 0.0 110.009 169.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 555' ' ' PRO . . . . . . . . . . . . . 91.7 Cg_endo -70.86 -29.52 18.53 Favored 'Trans proline' 0 CA--C 1.54 0.809 0 C-N-CA 123.736 2.957 . . . . 0.0 112.775 -179.794 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 26.4 pt-20 -70.89 -21.32 62.41 Favored 'General case' 0 CA--C 1.542 0.655 0 O-C-N 121.01 -1.056 . . . . 0.0 112.955 175.463 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 557' ' ' GLU . . . . . . . . . . . . . 40.8 mm-40 -79.6 -22.12 44.1 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.893 0.877 . . . . 0.0 113.1 179.165 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 558' ' ' GLN . . . . . 0.403 ' HA ' ' CE2' ' A' ' 552' ' ' PHE . 33.9 tt0 -69.72 103.64 2.2 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-O 122.731 1.253 . . . . 0.0 111.739 171.734 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . 0.254 48.7 m-20 -71.82 139.21 48.84 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 125.587 1.555 . . . . 0.0 114.427 174.395 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -70.18 124.6 24.52 Favored 'General case' 0 CA--C 1.541 0.629 0 O-C-N 120.754 -1.216 . . . . 0.0 110.944 -174.046 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 84.79 1.08 89.11 Favored Glycine 0 CA--C 1.54 1.595 0 N-CA-C 115.089 0.796 . . . . 0.0 115.089 -171.536 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 46.4 m95 -102.34 163.76 12.05 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 125.194 1.398 . . . . 0.0 113.554 179.564 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 14.5 mt -132.89 150.59 52.15 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 125.724 1.609 . . . . 0.0 109.856 170.155 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 54.8 ttm -106.12 140.57 38.88 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 124.208 1.003 . . . . 0.0 112.03 170.017 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -166.17 -172.57 33.66 Favored Glycine 0 CA--C 1.522 0.52 0 C-N-CA 124.37 0.986 . . . . 0.0 112.797 173.748 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 14.5 p -130.35 140.99 47.44 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.551 0 C-N-CA 125.405 1.482 . . . . 0.0 108.9 169.473 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 39.8 mtmt -58.6 136.24 57.56 Favored 'General case' 0 CA--C 1.52 -0.174 0 O-C-N 121.53 -0.731 . . . . 0.0 111.44 176.489 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -60.63 -40.89 93.59 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 117.663 -1.16 . . . . 0.0 111.783 -178.74 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 57.4 m -68.84 -35.59 77.14 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 120.52 1.509 . . . . 0.0 111.878 176.649 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -58.59 -33.11 69.62 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 114.05 1.129 . . . . 0.0 114.05 171.793 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 62.9 t-105 -84.77 -34.48 22.79 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.798 1.639 . . . . 0.0 113.888 174.709 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 7.8 t-20 -71.42 -22.0 61.91 Favored 'General case' 0 CA--C 1.552 1.023 0 C-N-CA 126.671 1.989 . . . . 0.0 111.984 175.006 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 41.4 mt-30 -85.55 -5.76 59.25 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 126.266 1.826 . . . . 0.0 113.04 167.083 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 21.7 m-70 58.49 38.38 25.53 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 127.392 2.277 . . . . 0.0 113.255 172.86 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 71.9 mttt -75.14 166.06 24.25 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 126.33 1.852 . . . . 0.0 112.476 177.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 3.2 pm0 -51.25 96.73 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 126.043 1.737 . . . . 0.0 114.644 177.685 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 42.8 tp -55.7 -49.32 73.32 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 126.057 1.743 . . . . 0.0 112.448 -170.079 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 64.0 mt-10 -67.73 -13.08 61.81 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 114.521 1.304 . . . . 0.0 114.521 -176.142 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 43.7 mmtm -105.18 -25.13 12.6 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 125.569 1.548 . . . . 0.0 112.898 172.466 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 90.3 m -82.61 -28.18 30.98 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 114.117 1.154 . . . . 0.0 114.117 178.109 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 36.4 ptt180 -70.24 161.65 29.91 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 124.454 1.102 . . . . 0.0 112.917 176.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -173.91 174.79 46.41 Favored Glycine 0 N--CA 1.468 0.812 0 C-N-CA 124.651 1.12 . . . . 0.0 114.493 176.526 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 13.1 m -93.27 137.33 22.77 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 C-N-CA 125.065 1.346 . . . . 0.0 112.7 172.033 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 39.8 p90 -132.33 155.68 80.99 Favored Pre-proline 0 CA--C 1.539 0.553 0 C-N-CA 125.098 1.359 . . . . 0.0 114.004 178.004 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 62.6 Cg_endo -66.75 107.82 1.34 Allowed 'Trans proline' 0 N--CA 1.458 -0.616 0 C-N-CA 122.49 2.127 . . . . 0.0 109.87 168.813 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 17.6 pt-20 -51.8 -30.06 21.66 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 124.558 1.143 . . . . 0.0 113.11 178.912 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 11.9 p-10 -70.67 -13.99 62.29 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 126.842 2.057 . . . . 0.0 114.33 179.437 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 9.9 m-85 -76.52 -14.62 60.01 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 116.384 1.994 . . . . 0.0 116.384 165.697 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 589' ' ' THR . . . . . 0.407 HG22 ' HA ' ' A' ' 527' ' ' ALA . 71.0 p -121.07 173.22 7.41 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 125.617 1.567 . . . . 0.0 111.871 -174.333 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -125.18 140.44 52.86 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 124.175 0.99 . . . . 0.0 110.195 171.417 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 15.4 tpt180 -62.97 114.74 3.86 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 124.682 1.193 . . . . 0.0 110.014 171.122 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 592' ' ' VAL . . . . . 0.44 HG23 ' HB2' ' A' ' 524' ' ' LYS . 2.0 m -96.2 154.47 38.77 Favored Pre-proline 0 N--CA 1.476 0.861 0 C-N-CA 124.521 1.128 . . . . 0.0 108.87 177.328 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 593' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo . . . . . 0 C--O 1.252 1.203 0 C-N-CA 124.292 3.328 . . . . 0.0 113.141 -177.297 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B 1728 ' ' SER . . . . . . . . . . . . . 9.3 p . . . . . 0 N--CA 1.477 0.919 0 N-CA-C 112.839 0.681 . . . . 0.0 112.839 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B 1729 ' ' THR . . . . . . . . . . . . 0.279 31.0 p 56.66 32.87 21.85 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 126.758 2.023 . . . . 0.0 115.374 163.724 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B 1730 ' ' VAL . . . . . . . . . . . . . 1.9 m -80.27 145.27 59.71 Favored Pre-proline 0 N--CA 1.48 1.06 0 N-CA-C 114.319 1.229 . . . . 0.0 114.319 176.634 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 79.7 Cg_endo -71.28 169.56 20.43 Favored 'Trans proline' 0 CA--C 1.542 0.91 0 C-N-CA 123.363 2.709 . . . . 0.0 113.185 172.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 11.8 t -132.12 128.27 58.87 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.12 0 C-N-CA 124.904 1.281 . . . . 0.0 112.71 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -67.21 136.63 93.85 Favored Pre-proline 0 CA--C 1.549 0.94 0 O-C-N 121.389 -0.82 . . . . 0.0 112.633 -176.896 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -77.41 162.28 30.92 Favored 'Trans proline' 0 CA--C 1.548 1.183 0 C-N-CA 123.032 2.488 . . . . 0.0 113.561 -175.559 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 61.8 Cg_endo -71.61 125.93 11.63 Favored 'Trans proline' 0 CA--C 1.54 0.794 0 C-N-CA 123.447 2.765 . . . . 0.0 112.909 -178.709 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B 1736 ' ' ARG . . . . . . . . . . . . . 1.9 mpp_? -77.78 155.46 31.13 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 125.218 1.407 . . . . 0.0 111.128 172.799 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B 1737 ' ' ARG . . . . . . . . . . . . . 11.9 mmt85 -120.09 160.52 22.69 Favored 'General case' 0 N--CA 1.479 1.008 0 N-CA-C 112.912 0.708 . . . . 0.0 112.912 -165.041 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B 1738 ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -57.33 143.93 37.91 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 123.81 0.844 . . . . 0.0 112.399 178.57 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B 1739 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -153.07 154.37 34.74 Favored 'General case' 0 N--CA 1.479 1.019 0 N-CA-C 113.288 0.848 . . . . 0.0 113.288 164.018 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B 1740 ' ' GLY . . . . . . . . . . . . . . . 65.28 24.76 70.81 Favored Glycine 0 CA--C 1.537 1.463 0 C-N-CA 124.283 0.944 . . . . 0.0 115.03 179.541 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B 1741 ' ' ARG . . . . . . . . . . . . . 64.8 ttt-85 -74.03 129.98 38.94 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 124.974 1.31 . . . . 0.0 112.033 -173.505 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B 1742 ' ' ASN . . . . . . . . . . . . . 2.0 t30 -155.83 138.18 14.83 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.943 1.297 . . . . 0.0 111.9 -177.137 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B 1743 ' ' LEU . . . . . . . . . . . . . 94.8 mt -140.6 163.15 33.64 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 126.299 1.839 . . . . 0.0 110.753 176.424 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B 1744 ' ' THR . . . . . . . . . . . . 0.278 0.2 OUTLIER . . . . . 0 C--O 1.257 1.472 0 N-CA-C 117.378 2.362 . . . . 0.0 117.378 -178.745 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 513' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.773 0 N-CA-C 111.427 -0.669 . . . . 0.0 111.427 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 514' ' ' ARG . . . . . . . . . . . . . 17.7 mmt180 -138.09 153.8 49.27 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 126.66 1.984 . . . . 0.0 112.74 176.508 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 49.2 tp -120.91 -20.4 6.92 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.551 1.541 . . . . 0.0 113.255 174.079 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 516' ' ' ASP . . . . . . . . . . . . 0.322 2.3 p-10 -66.9 112.23 4.19 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 119.353 0.979 . . . . 0.0 112.475 148.866 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 517' ' ' LEU . . . . . 0.48 HD22 HD22 ' A' ' 548' ' ' LEU . 12.1 mt -127.96 160.36 61.8 Favored Pre-proline 0 CA--C 1.537 0.469 0 C-N-CA 124.86 1.264 . . . . 0.0 111.213 -161.325 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -64.47 159.48 44.09 Favored 'Trans proline' 0 N--CA 1.458 -0.591 0 C-N-CA 122.986 2.457 . . . . 0.0 112.94 -174.178 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -62.5 135.58 54.06 Favored 'Trans proline' 0 N--CA 1.457 -0.662 0 C-N-CA 122.503 2.135 . . . . 0.0 109.89 177.318 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 77.57 -3.69 58.76 Favored Glycine 0 CA--C 1.531 1.06 0 CA-C-O 117.358 -1.801 . . . . 0.0 115.217 -179.762 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 32.8 t80 -34.64 125.05 0.53 Allowed 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 117.202 2.297 . . . . 0.0 117.202 -176.781 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 45.7 mtm -94.45 -51.43 4.77 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 112.241 0.46 . . . . 0.0 112.241 -178.019 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 523' ' ' PHE . . . . . . . . . . . . . 22.6 p90 -171.0 167.12 7.35 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 127.645 2.378 . . . . 0.0 112.609 -172.072 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 524' ' ' LYS . . . . . 0.473 ' HB2' HG23 ' A' ' 592' ' ' VAL . 72.1 mttt -96.81 160.27 14.46 Favored 'General case' 0 CA--C 1.534 0.332 0 O-C-N 121.234 -0.916 . . . . 0.0 111.027 166.699 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 32.1 m -134.56 158.49 41.77 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 C-N-CA 126.297 1.839 . . . . 0.0 108.614 166.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 40.1 tt0 -125.43 130.16 51.29 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-N 119.327 0.967 . . . . 0.0 112.343 173.989 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 527' ' ' ALA . . . . . 0.558 ' HA ' HG22 ' A' ' 589' ' ' THR . . . -64.98 117.9 8.3 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 124.488 1.115 . . . . 0.0 111.426 -177.669 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 75.7 mm-40 -80.87 -29.13 35.8 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 123.474 0.709 . . . . 0.0 111.459 173.497 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 97.8 m-70 -136.83 160.11 39.84 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 125.894 1.678 . . . . 0.0 111.295 -177.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . 0.312 4.6 p30 -82.33 136.36 35.03 Favored 'General case' 0 CA--C 1.546 0.807 0 N-CA-C 115.651 1.723 . . . . 0.0 115.651 178.817 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 82.3 t80 -140.26 128.75 22.78 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 126.095 1.758 . . . . 0.0 112.955 -178.551 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 2.6 m -104.17 135.77 45.03 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 124.864 1.266 . . . . 0.0 113.985 175.501 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -73.23 126.77 30.85 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 112.85 0.685 . . . . 0.0 112.85 -173.452 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 2.8 p -90.96 -3.66 57.12 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 127.757 2.423 . . . . 0.0 116.051 177.669 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 24.6 t0 -148.97 159.47 44.17 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.383 1.473 . . . . 0.0 107.878 -170.225 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 2.0 t -67.24 -20.86 65.73 Favored 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 115.048 1.499 . . . . 0.0 115.048 169.448 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 13.8 t0 -82.53 -20.36 36.8 Favored 'General case' 0 CA--C 1.551 0.986 0 C-N-CA 123.349 0.66 . . . . 0.0 110.426 177.562 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 72.1 mt-10 -82.13 153.12 26.2 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 125.252 1.421 . . . . 0.0 114.744 -173.867 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -98.54 139.1 34.78 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 127.684 2.393 . . . . 0.0 110.307 176.668 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 14.3 tt0 -91.38 130.88 37.17 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.001 0.92 . . . . 0.0 111.07 172.233 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 73.4 mt -128.61 139.96 52.01 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 124.939 1.296 . . . . 0.0 112.245 -177.535 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 14.3 tmtt? -110.55 145.7 37.33 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 126.257 1.823 . . . . 0.0 109.872 171.177 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -59.21 94.24 0.02 OUTLIER 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 124.231 1.013 . . . . 0.0 112.5 177.675 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 131.45 -8.81 5.6 Favored Glycine 0 CA--C 1.532 1.099 0 C-N-CA 126.522 2.01 . . . . 0.0 114.758 -173.399 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 86.2 m-20 -70.7 122.22 19.41 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 119.766 1.783 . . . . 0.0 114.248 -178.547 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 3.4 t -72.2 135.96 26.71 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.415 0 CA-C-N 118.378 0.535 . . . . 0.0 110.546 163.281 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 1.3 t -125.1 123.78 66.1 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.453 0 C-N-CA 126.749 2.02 . . . . 0.0 110.607 177.052 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 548' ' ' LEU . . . . . 0.48 HD22 HD22 ' A' ' 517' ' ' LEU . 26.7 mt -81.38 98.69 8.32 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 108.15 -1.056 . . . . 0.0 108.15 177.752 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 549' ' ' VAL . . . . . . . . . . . . . 5.9 t -62.93 132.05 28.62 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.132 0 N-CA-C 114.315 1.228 . . . . 0.0 114.315 175.277 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 15.0 pt -126.63 154.72 75.53 Favored Pre-proline 0 CA--C 1.546 0.807 0 C-N-CA 126.502 1.921 . . . . 0.0 110.395 176.865 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 89.4 Cg_endo -75.69 142.37 25.76 Favored 'Trans proline' 0 C--O 1.241 0.645 0 C-N-CA 123.901 3.067 . . . . 0.0 111.807 177.465 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 48.4 m-85 -60.73 149.56 35.13 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 115.552 1.686 . . . . 0.0 115.552 178.757 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 553' ' ' GLN . . . . . 0.57 ' CD ' ' H ' ' A' ' 553' ' ' GLN . 0.0 OUTLIER -67.6 -29.42 68.76 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 124.993 1.317 . . . . 0.0 113.227 174.874 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 8.4 m-20 -150.54 149.81 27.11 Favored Pre-proline 0 CA--C 1.539 0.556 0 C-N-CA 125.019 1.327 . . . . 0.0 112.186 169.85 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 555' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -67.1 -37.73 17.96 Favored 'Trans proline' 0 CA--C 1.537 0.651 0 C-N-CA 123.123 2.549 . . . . 0.0 111.957 174.112 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 24.0 pt-20 -68.76 -11.72 60.65 Favored 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 114.024 1.12 . . . . 0.0 114.024 176.013 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 557' ' ' GLU . . . . . . . . . . . . . 72.3 mm-40 -90.32 -27.27 19.52 Favored 'General case' 0 CA--C 1.539 0.55 0 O-C-N 121.292 -0.88 . . . . 0.0 112.764 173.471 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 48.2 tt0 -66.7 125.25 25.22 Favored 'General case' 0 C--O 1.236 0.346 0 C-N-CA 125.055 1.342 . . . . 0.0 112.388 179.473 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 56.2 m-20 -82.67 141.81 32.18 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 125.262 1.425 . . . . 0.0 109.324 175.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 87.4 tt0 -76.94 125.94 30.15 Favored 'General case' 0 N--CA 1.471 0.59 0 O-C-N 120.633 -1.292 . . . . 0.0 110.543 -176.181 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 84.64 7.81 83.84 Favored Glycine 0 CA--C 1.537 1.466 0 CA-C-O 118.869 -0.962 . . . . 0.0 114.978 -171.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 43.3 m95 -111.7 155.97 22.62 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 125.709 1.603 . . . . 0.0 114.016 -179.6 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 12.6 mt -123.96 159.3 30.07 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.384 1.073 . . . . 0.0 110.725 172.098 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 51.9 ttm -118.32 143.25 46.75 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 125.051 1.341 . . . . 0.0 111.383 173.004 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -173.56 -167.54 33.43 Favored Glycine 0 CA--C 1.525 0.707 0 C-N-CA 124.256 0.931 . . . . 0.0 112.741 178.277 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 14.7 p -136.03 142.02 40.06 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 C-N-CA 125.378 1.471 . . . . 0.0 109.342 172.738 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 36.4 mtmt -58.1 135.09 56.96 Favored 'General case' 0 N--CA 1.468 0.475 0 O-C-N 121.338 -0.851 . . . . 0.0 110.876 174.989 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -59.41 -39.49 83.61 Favored 'General case' 0 C--O 1.221 -0.43 0 CA-C-O 117.711 -1.138 . . . . 0.0 111.349 177.35 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 7.6 t -68.14 -35.39 78.0 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 120.294 1.406 . . . . 0.0 111.239 179.396 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 83.8 m-20 -65.1 -33.48 76.13 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 115.184 1.55 . . . . 0.0 115.184 171.9 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 58.4 t-105 -83.72 -32.14 25.67 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 125.08 1.352 . . . . 0.0 113.235 175.505 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 18.4 t-20 -75.2 -14.02 60.5 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 127.133 2.173 . . . . 0.0 111.982 172.47 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 8.6 mm-40 -82.45 -4.78 58.02 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 126.676 1.99 . . . . 0.0 113.846 162.705 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 574' ' ' HIS . . . . . . . . . . . . 0.251 69.4 m-70 57.47 27.92 14.7 Favored 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 126.268 1.827 . . . . 0.0 114.735 -179.376 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 22.4 mtpp -72.35 161.82 30.31 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 126.322 1.849 . . . . 0.0 112.893 179.293 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -59.88 105.05 0.34 Allowed 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.184 1.394 . . . . 0.0 113.546 179.109 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 58.6 tp -56.95 -42.58 80.37 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 126.017 1.727 . . . . 0.0 112.283 -174.528 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 15.2 pm0 -55.96 -33.07 64.44 Favored 'General case' 0 CA--C 1.542 0.662 0 N-CA-C 114.545 1.313 . . . . 0.0 114.545 178.257 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 2.0 tppp? -88.98 -43.48 11.1 Favored 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 125.447 1.499 . . . . 0.0 110.786 177.924 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 87.2 m -74.83 -24.54 58.62 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 126.457 1.903 . . . . 0.0 115.146 -173.474 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 46.9 ptt85 -63.56 165.62 7.81 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 125.035 1.334 . . . . 0.0 113.585 177.598 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -172.6 174.9 45.76 Favored Glycine 0 CA--C 1.525 0.701 0 CA-C-N 115.031 -0.986 . . . . 0.0 114.639 165.534 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 32.7 m -91.97 144.51 9.11 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 C-N-CA 124.264 1.026 . . . . 0.0 111.085 166.221 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 38.3 p90 -138.24 154.38 73.85 Favored Pre-proline 0 CA--C 1.539 0.543 0 C-N-CA 125.02 1.328 . . . . 0.0 113.055 177.183 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 65.2 Cg_endo -66.71 108.79 1.51 Allowed 'Trans proline' 0 N--CA 1.457 -0.649 0 C-N-CA 121.786 1.657 . . . . 0.0 109.141 170.259 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -58.83 -21.57 56.92 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 124.01 0.924 . . . . 0.0 113.27 -178.717 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 10.5 p-10 -73.45 -8.19 54.85 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 125.752 1.621 . . . . 0.0 114.16 174.147 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 13.0 m-85 -82.7 -16.5 47.9 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 116.047 1.869 . . . . 0.0 116.047 168.036 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 589' ' ' THR . . . . . 0.558 HG22 ' HA ' ' A' ' 527' ' ' ALA . 17.7 p -122.13 -179.99 4.35 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.449 1.5 . . . . 0.0 108.452 -172.112 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -140.92 142.55 34.41 Favored 'General case' 0 CA--C 1.536 0.429 0 O-C-N 120.721 -1.237 . . . . 0.0 110.23 171.021 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -52.37 135.73 32.58 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 125.407 1.483 . . . . 0.0 110.811 172.968 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 592' ' ' VAL . . . . . 0.473 HG23 ' HB2' ' A' ' 524' ' ' LYS . 1.7 m -135.6 152.58 76.53 Favored Pre-proline 0 N--CA 1.475 0.816 0 C-N-CA 125.574 1.55 . . . . 0.0 109.412 175.055 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 593' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_endo . . . . . 0 C--O 1.253 1.235 0 C-N-CA 124.588 3.525 . . . . 0.0 112.956 178.833 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B 1728 ' ' SER . . . . . . . . . . . . . 32.7 p . . . . . 0 N--CA 1.474 0.744 0 CA-C-O 119.632 -0.223 . . . . 0.0 110.492 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B 1729 ' ' THR . . . . . . . . . . . . . 8.4 t -70.92 -32.53 69.48 Favored 'General case' 0 N--CA 1.485 1.314 0 N-CA-C 114.235 1.198 . . . . 0.0 114.235 177.162 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B 1730 ' ' VAL . . . . . . . . . . . . . 5.5 m -73.52 152.84 89.76 Favored Pre-proline 0 CA--C 1.542 0.667 0 C-N-CA 126.562 1.945 . . . . 0.0 113.089 179.461 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -71.03 161.73 45.08 Favored 'Trans proline' 0 CA--C 1.54 0.792 0 C-N-CA 122.738 2.292 . . . . 0.0 113.865 -176.579 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 6.8 p -135.05 126.36 46.45 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.706 0 C-N-CA 126.364 1.865 . . . . 0.0 110.387 -177.692 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -65.49 135.9 95.99 Favored Pre-proline 0 CA--C 1.546 0.801 0 O-C-N 121.172 -0.955 . . . . 0.0 111.778 -175.515 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 4.5 Cg_endo -69.07 162.81 40.19 Favored 'Trans proline' 0 CA--C 1.539 0.752 0 C-N-CA 122.292 1.995 . . . . 0.0 112.179 177.896 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -63.07 154.64 66.02 Favored 'Trans proline' 0 CA--C 1.538 0.696 0 C-N-CA 122.537 2.158 . . . . 0.0 111.842 168.345 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B 1736 ' ' ARG . . . . . . . . . . . . . 46.0 mtp180 -114.85 171.3 7.73 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 125.401 1.481 . . . . 0.0 113.062 177.877 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B 1737 ' ' ARG . . . . . . . . . . . . . 14.5 mmt180 -118.02 135.02 54.43 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 125.483 1.513 . . . . 0.0 111.529 175.434 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B 1738 ' ' ARG . . . . . . . . . . . . . 4.1 tpm_? -64.46 -41.7 96.37 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 124.361 1.065 . . . . 0.0 110.073 163.219 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B 1739 ' ' ARG . . . . . . . . . . . . . 8.5 tpp180 -151.2 142.61 23.43 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 125.966 1.707 . . . . 0.0 109.702 160.034 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B 1740 ' ' GLY . . . . . . . . . . . . . . . -62.79 157.55 38.36 Favored Glycine 0 CA--C 1.531 1.083 0 C-N-CA 124.147 0.879 . . . . 0.0 114.769 -174.5 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B 1741 ' ' ARG . . . . . . . . . . . . . 14.2 tpp180 -116.83 117.6 30.17 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 124.947 1.299 . . . . 0.0 110.425 174.74 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B 1742 ' ' ASN . . . . . . . . . . . . . 55.2 t30 -81.84 138.89 35.01 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 123.205 0.602 . . . . 0.0 110.906 171.07 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B 1743 ' ' LEU . . . . . . . . . . . . . 94.1 mt -132.32 122.93 25.87 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 124.966 1.306 . . . . 0.0 108.067 167.534 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B 1744 ' ' THR . . . . . . . . . . . . 0.33 0.6 OUTLIER . . . . . 0 C--O 1.25 1.123 0 N-CA-C 117.306 2.336 . . . . 0.0 117.306 -168.12 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 513' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.241 0 N-CA-C 110.881 -0.888 . . . . 0.0 110.881 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 514' ' ' ARG . . . . . . . . . . . . . 5.3 mmm180 -130.5 146.77 52.1 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 126.552 1.941 . . . . 0.0 112.814 178.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 39.9 tp -74.02 -20.15 60.41 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 125.629 1.571 . . . . 0.0 114.385 -179.012 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 516' ' ' ASP . . . . . . . . . . . . . 21.6 t0 -112.56 145.91 39.48 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 124.841 1.257 . . . . 0.0 112.202 174.83 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 517' ' ' LEU . . . . . 0.415 HD22 HD22 ' A' ' 548' ' ' LEU . 11.0 mt -121.56 161.38 41.85 Favored Pre-proline 0 CA--C 1.542 0.652 0 C-N-CA 126.123 1.769 . . . . 0.0 111.517 -176.172 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_endo -68.06 159.36 53.39 Favored 'Trans proline' 0 CA--C 1.54 0.796 0 C-N-CA 123.458 2.772 . . . . 0.0 113.709 -173.768 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -62.92 126.78 18.78 Favored 'Trans proline' 0 C--N 1.347 0.492 0 C-N-CA 123.763 2.976 . . . . 0.0 111.182 -178.44 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 78.72 1.19 83.02 Favored Glycine 0 CA--C 1.533 1.172 0 CA-C-O 117.385 -1.786 . . . . 0.0 115.653 -177.265 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 27.1 t80 -34.84 137.22 0.13 Allowed 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 117.192 2.293 . . . . 0.0 117.192 179.222 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 39.6 mtm -106.29 -61.85 1.46 Allowed 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 123.891 0.876 . . . . 0.0 111.928 -178.073 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 523' ' ' PHE . . . . . . . . . . . . . 23.9 p90 -161.06 170.17 21.02 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 127.28 2.232 . . . . 0.0 112.082 -172.724 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 524' ' ' LYS . . . . . 0.603 ' HB2' HG23 ' A' ' 592' ' ' VAL . 71.9 mttt -104.9 163.83 12.24 Favored 'General case' 0 N--CA 1.467 0.399 0 O-C-N 121.148 -0.97 . . . . 0.0 111.288 170.358 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 8.3 m -132.4 156.53 42.5 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.881 0 C-N-CA 126.299 1.84 . . . . 0.0 109.651 165.894 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 44.2 tt0 -118.38 129.87 55.67 Favored 'General case' 0 N--CA 1.477 0.877 0 CA-C-N 119.795 1.18 . . . . 0.0 111.913 169.394 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 527' ' ' ALA . . . . . 0.513 ' HA ' HG22 ' A' ' 589' ' ' THR . . . -62.11 121.8 13.96 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.155 0.982 . . . . 0.0 111.786 177.766 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 71.7 mm-40 -89.49 -18.15 27.26 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 125.957 1.703 . . . . 0.0 111.978 172.978 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 98.7 m-70 -144.93 161.5 39.2 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 127.577 2.351 . . . . 0.0 109.759 -175.443 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -89.5 133.06 34.74 Favored 'General case' 0 C--O 1.237 0.429 0 N-CA-C 107.079 -1.452 . . . . 0.0 107.079 -179.524 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 88.2 t80 -122.61 106.19 10.76 Favored 'General case' 0 C--O 1.235 0.306 0 C-N-CA 124.772 1.229 . . . . 0.0 113.232 177.59 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -80.6 113.84 19.07 Favored 'General case' 0 N--CA 1.469 0.503 0 N-CA-C 113.251 0.834 . . . . 0.0 113.251 170.071 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -71.47 141.63 50.21 Favored 'General case' 0 C--O 1.238 0.485 0 C-N-CA 125.244 1.418 . . . . 0.0 111.881 179.747 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 5.7 t -110.65 -37.01 5.57 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 126.178 1.791 . . . . 0.0 113.455 177.92 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 84.8 m-20 -95.11 152.48 18.31 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 116.968 2.21 . . . . 0.0 116.968 -177.547 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 4.2 t -57.12 -26.89 61.24 Favored 'General case' 0 N--CA 1.481 1.084 0 N-CA-C 116.138 1.903 . . . . 0.0 116.138 179.812 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 537' ' ' ASP . . . . . 0.48 ' CG ' HH22 ' B' 1736 ' ' ARG . 8.2 p30 -92.61 -9.37 41.27 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 116.788 2.144 . . . . 0.0 116.788 174.742 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 86.3 mt-10 -75.69 152.11 37.58 Favored 'General case' 0 CA--C 1.537 0.457 0 O-C-N 120.96 -1.088 . . . . 0.0 113.913 -177.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -97.97 132.48 43.5 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 127.561 2.344 . . . . 0.0 109.521 171.577 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 30.0 tt0 -90.03 134.45 34.23 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.037 0.935 . . . . 0.0 111.519 174.912 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 83.1 mt -127.63 155.36 44.0 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 125.007 1.323 . . . . 0.0 112.819 -178.196 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -129.12 142.31 50.92 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 125.556 1.542 . . . . 0.0 109.728 174.029 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -54.8 105.89 0.18 Allowed 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.34 1.056 . . . . 0.0 112.04 -175.616 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 125.43 -15.01 7.24 Favored Glycine 0 CA--C 1.531 1.061 0 C-N-CA 126.684 2.087 . . . . 0.0 113.814 -176.627 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 84.9 m-20 -73.83 119.64 18.33 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 114.909 1.448 . . . . 0.0 114.909 -171.164 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 21.8 t -70.14 137.78 23.34 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 O-C-N 122.057 -0.402 . . . . 0.0 110.83 169.178 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 1.1 t -125.84 127.55 71.36 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 C-N-CA 126.538 1.935 . . . . 0.0 111.399 174.957 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 548' ' ' LEU . . . . . 0.439 ' CD2' ' HE2' ' A' ' 524' ' ' LYS . 20.4 mt -83.76 101.7 11.78 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.356 1.063 . . . . 0.0 108.742 177.495 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 549' ' ' VAL . . . . . . . . . . . . . 6.3 t -63.88 131.12 29.43 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 N-CA-C 113.986 1.106 . . . . 0.0 113.986 174.436 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 24.6 pt -127.11 157.25 72.79 Favored Pre-proline 0 CA--C 1.548 0.87 0 C-N-CA 126.426 1.89 . . . . 0.0 110.276 177.606 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -70.93 156.43 60.3 Favored 'Trans proline' 0 CA--C 1.534 0.519 0 C-N-CA 123.779 2.986 . . . . 0.0 111.54 174.498 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 54.9 m-85 -72.19 151.22 43.08 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 115.72 1.748 . . . . 0.0 115.72 175.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 553' ' ' GLN . . . . . . . . . . . . . 6.2 pt20 -63.39 -29.51 70.8 Favored 'General case' 0 CA--C 1.544 0.712 0 O-C-N 121.487 -0.758 . . . . 0.0 112.659 169.397 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 3.8 m-20 -156.22 153.19 24.83 Favored Pre-proline 0 CA--C 1.545 0.781 0 C-N-CA 125.332 1.453 . . . . 0.0 111.95 -175.645 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 555' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_endo -70.41 -29.61 20.49 Favored 'Trans proline' 0 CA--C 1.539 0.726 0 C-N-CA 123.813 3.009 . . . . 0.0 112.712 -178.601 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 23.7 pt-20 -73.66 -14.8 61.22 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 124.862 1.265 . . . . 0.0 112.736 176.672 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 557' ' ' GLU . . . . . . . . . . . . . 73.7 mm-40 -84.64 -20.9 30.59 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 123.991 0.916 . . . . 0.0 113.206 -178.106 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 4.1 tp60 -75.15 147.06 40.81 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 125.505 1.522 . . . . 0.0 113.178 176.076 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 13.0 m-20 -120.3 156.29 31.56 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 128.173 2.589 . . . . 0.0 116.125 178.66 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -71.31 110.86 6.21 Favored 'General case' 0 N--CA 1.473 0.716 0 O-C-N 120.345 -1.472 . . . . 0.0 114.093 -165.783 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 82.69 7.63 87.13 Favored Glycine 0 CA--C 1.539 1.545 0 O-C-N 121.117 -0.989 . . . . 0.0 114.605 -175.415 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 47.6 m95 -89.64 165.96 13.91 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 126.013 1.725 . . . . 0.0 113.456 176.407 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 18.9 mt -138.48 158.05 45.0 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 126.003 1.721 . . . . 0.0 110.317 170.4 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 47.8 ttm -115.32 142.78 46.23 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 125.058 1.343 . . . . 0.0 112.078 174.011 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -171.8 -174.8 39.61 Favored Glycine 0 CA--C 1.527 0.812 0 C-N-CA 123.771 0.701 . . . . 0.0 113.328 178.056 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 12.1 p -128.11 141.23 47.02 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.829 0 C-N-CA 125.742 1.617 . . . . 0.0 109.15 171.384 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 31.8 mtmt -57.72 136.56 56.89 Favored 'General case' 0 N--CA 1.467 0.411 0 O-C-N 121.328 -0.858 . . . . 0.0 111.563 175.519 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 15.9 tt0 -58.06 -43.58 86.99 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 118.555 -0.736 . . . . 0.0 110.909 176.809 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 38.5 t -65.68 -36.25 83.1 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-N 118.932 0.787 . . . . 0.0 112.583 178.172 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 79.4 m-20 -65.3 -42.53 92.97 Favored 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 114.828 1.418 . . . . 0.0 114.828 173.515 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 72.9 t-105 -69.04 -35.55 76.72 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.564 1.146 . . . . 0.0 112.92 173.914 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 50.9 t-20 -69.06 -31.35 70.05 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 127.429 2.292 . . . . 0.0 111.737 173.891 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 12.5 mm-40 -82.45 0.74 40.84 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.966 1.306 . . . . 0.0 114.149 172.373 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 83.6 m-70 57.26 38.31 28.63 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 126.753 2.021 . . . . 0.0 113.706 178.268 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 22.3 mtpp -86.31 159.05 19.53 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 125.595 1.558 . . . . 0.0 111.043 179.881 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 12.6 pm0 -56.49 98.71 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 115.029 1.492 . . . . 0.0 115.029 -167.179 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 44.6 tp -50.64 -47.18 58.53 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 125.042 1.337 . . . . 0.0 112.665 -173.229 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 72.4 mm-40 -66.27 -12.64 57.62 Favored 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 114.371 1.248 . . . . 0.0 114.371 -174.124 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 13.1 tptp -117.83 -33.16 4.59 Favored 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 125.501 1.521 . . . . 0.0 113.173 177.684 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 71.1 m -65.22 -31.83 73.19 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 125.635 1.574 . . . . 0.0 112.504 173.119 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 29.6 ptt85 -60.1 157.07 13.73 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 123.737 0.815 . . . . 0.0 112.668 172.215 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -171.96 173.91 45.21 Favored Glycine 0 CA--C 1.524 0.62 0 C-N-CA 123.991 0.805 . . . . 0.0 113.205 173.707 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 35.1 m -91.37 141.43 14.47 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.428 0 C-N-CA 124.008 0.923 . . . . 0.0 110.982 169.356 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 50.5 p90 -137.74 154.6 74.89 Favored Pre-proline 0 CA--C 1.538 0.498 0 C-N-CA 123.959 0.903 . . . . 0.0 113.125 175.838 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_endo -70.37 110.07 2.59 Favored 'Trans proline' 0 N--CA 1.458 -0.613 0 C-N-CA 122.207 1.938 . . . . 0.0 110.034 172.11 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 20.8 pt-20 -55.83 -26.53 47.08 Favored 'General case' 0 N--CA 1.474 0.756 0 O-C-N 121.308 -0.87 . . . . 0.0 112.675 -178.805 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 6.6 p-10 -65.35 -15.36 62.48 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 126.131 1.772 . . . . 0.0 114.48 178.199 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 27.5 m-85 -77.48 -10.99 59.79 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 116.582 2.068 . . . . 0.0 116.582 165.537 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 589' ' ' THR . . . . . 0.513 HG22 ' HA ' ' A' ' 527' ' ' ALA . 80.6 p -131.27 169.78 15.5 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 126.131 1.772 . . . . 0.0 111.734 -171.806 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -125.23 142.45 51.49 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 123.987 0.915 . . . . 0.0 110.228 172.23 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.55 134.5 56.18 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 125.252 1.421 . . . . 0.0 110.999 172.009 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 592' ' ' VAL . . . . . 0.603 HG23 ' HB2' ' A' ' 524' ' ' LYS . 5.4 m -126.67 151.53 73.42 Favored Pre-proline 0 CA--C 1.553 1.06 0 C-N-CA 124.785 1.234 . . . . 0.0 111.584 -178.546 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 593' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo . . . . . 0 C--O 1.252 1.209 1 C-N-CA 125.707 4.272 . . . . 0.0 117.182 -168.451 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B 1728 ' ' SER . . . . . . . . . . . . . 12.2 t . . . . . 0 N--CA 1.473 0.712 0 CA-C-O 120.597 0.237 . . . . 0.0 110.553 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B 1729 ' ' THR . . . . . . . . . . . . 0.387 0.2 OUTLIER 62.12 27.01 16.28 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 116.92 2.193 . . . . 0.0 116.92 176.044 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B 1730 ' ' VAL . . . . . . . . . . . . 0.292 1.1 m -111.84 142.55 26.9 Favored Pre-proline 0 N--CA 1.479 1.023 0 C-N-CA 125.139 1.375 . . . . 0.0 114.482 174.588 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 49.8 Cg_endo -69.58 178.17 4.72 Favored 'Trans proline' 0 CA--C 1.547 1.125 0 C-N-CA 124.77 3.646 . . . . 0.0 115.25 -176.675 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 60.3 t -132.65 129.87 58.93 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.068 0 C-N-CA 125.9 1.68 . . . . 0.0 110.73 178.572 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -65.08 131.41 95.15 Favored Pre-proline 0 CA--C 1.556 1.185 0 O-C-N 121.481 -0.762 . . . . 0.0 112.924 -177.348 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 50.4 Cg_endo -74.06 157.3 46.83 Favored 'Trans proline' 0 CA--C 1.541 0.842 0 C-N-CA 123.105 2.537 . . . . 0.0 114.111 -170.15 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -65.71 117.25 4.46 Favored 'Trans proline' 0 CA--C 1.535 0.56 0 C-N-CA 123.808 3.005 . . . . 0.0 112.802 -172.291 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B 1736 ' ' ARG . . . . . 0.48 HH22 ' CG ' ' A' ' 537' ' ' ASP . 83.2 mtp180 -78.47 149.5 33.19 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 125.346 1.458 . . . . 0.0 111.204 176.07 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B 1737 ' ' ARG . . . . . . . . . . . . . 12.9 mtp180 -87.81 -176.82 5.64 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 126.525 1.93 . . . . 0.0 112.027 -173.043 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B 1738 ' ' ARG . . . . . . . . . . . . . 66.1 mtt-85 -84.85 136.07 33.81 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 123.511 0.724 . . . . 0.0 110.041 158.745 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B 1739 ' ' ARG . . . . . . . . . . . . . 15.0 mtt85 -69.22 -28.57 66.48 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 126.336 1.854 . . . . 0.0 113.914 173.342 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B 1740 ' ' GLY . . . . . . . . . . . . . . . 179.24 -176.04 47.56 Favored Glycine 0 CA--C 1.531 1.069 0 N-CA-C 114.388 0.515 . . . . 0.0 114.388 -176.346 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B 1741 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.36 142.77 58.27 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.16 0.984 . . . . 0.0 111.407 175.246 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B 1742 ' ' ASN . . . . . . . . . . . . . 75.7 m-20 -77.09 89.97 3.61 Favored 'General case' 0 C--O 1.238 0.472 0 C-N-CA 124.455 1.102 . . . . 0.0 110.741 175.883 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B 1743 ' ' LEU . . . . . . . . . . . . . 51.4 tp -158.65 124.92 4.6 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 127.248 2.219 . . . . 0.0 109.03 -178.477 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B 1744 ' ' THR . . . . . . . . . . . . . 2.2 t . . . . . 0 C--O 1.25 1.087 0 C-N-CA 124.95 1.3 . . . . 0.0 114.224 -179.584 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 513' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.804 0 N-CA-C 110.32 -1.112 . . . . 0.0 110.32 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 514' ' ' ARG . . . . . . . . . . . . . 2.4 mmp_? -121.47 152.97 38.53 Favored 'General case' 0 N--CA 1.48 1.047 0 N-CA-C 114.839 1.422 . . . . 0.0 114.839 178.477 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 5.9 mp -86.13 -3.66 59.0 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 124.962 1.305 . . . . 0.0 112.756 174.149 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 516' ' ' ASP . . . . . . . . . . . . . 32.5 p-10 -134.75 133.57 40.05 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 126.538 1.935 . . . . 0.0 114.873 178.284 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 517' ' ' LEU . . . . . 0.408 HD22 HD22 ' A' ' 548' ' ' LEU . 10.6 mt -121.96 160.88 45.25 Favored Pre-proline 0 CA--C 1.552 1.042 0 N-CA-C 114.61 1.337 . . . . 0.0 114.61 -164.172 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -71.0 161.14 47.12 Favored 'Trans proline' 0 CA--C 1.541 0.867 0 C-N-CA 124.655 3.57 . . . . 0.0 113.981 -172.205 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -68.19 123.95 11.19 Favored 'Trans proline' 0 C--O 1.239 0.542 0 C-N-CA 123.481 2.787 . . . . 0.0 111.818 -173.488 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 82.15 1.53 90.37 Favored Glycine 0 CA--C 1.537 1.415 0 CA-C-O 117.757 -1.579 . . . . 0.0 115.808 -175.454 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 30.6 t80 -34.18 132.02 0.28 Allowed 'General case' 0 CA--C 1.546 0.808 0 N-CA-C 118.435 2.754 . . . . 0.0 118.435 -178.53 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 31.7 mtm -101.59 -53.93 2.87 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 113.479 0.918 . . . . 0.0 113.479 -176.732 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 523' ' ' PHE . . . . . 0.46 ' CE1' HG21 ' A' ' 549' ' ' VAL . 19.3 p90 -170.02 171.09 7.21 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 126.508 1.923 . . . . 0.0 111.893 -173.299 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 524' ' ' LYS . . . . . 0.516 ' HE2' ' CD2' ' A' ' 548' ' ' LEU . 76.5 mttt -104.61 163.21 12.64 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-O 122.228 1.013 . . . . 0.0 111.684 167.904 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 12.3 m -134.34 162.44 39.01 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 126.552 1.941 . . . . 0.0 109.55 165.317 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 52.5 tt0 -127.28 129.8 48.38 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 119.035 0.834 . . . . 0.0 112.137 171.136 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 527' ' ' ALA . . . . . 0.569 ' HA ' HG22 ' A' ' 589' ' ' THR . . . -62.84 129.62 41.27 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.119 0.967 . . . . 0.0 111.302 -178.644 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 62.6 mm-40 -98.08 -12.8 21.46 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 124.915 1.286 . . . . 0.0 112.708 173.461 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 89.0 m-70 -146.74 160.14 42.6 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 128.064 2.545 . . . . 0.0 109.243 -179.87 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 21.4 p-10 -78.53 146.14 34.47 Favored 'General case' 0 N--CA 1.466 0.375 0 O-C-N 121.432 -0.792 . . . . 0.0 111.853 170.061 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 79.3 t80 -139.72 118.27 12.24 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 124.999 1.32 . . . . 0.0 110.846 175.71 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 2.2 m -91.57 132.14 36.51 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 124.909 1.284 . . . . 0.0 113.883 173.546 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -71.19 120.83 17.33 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 123.584 0.754 . . . . 0.0 112.321 -171.208 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 2.4 p -89.23 -5.53 57.58 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 126.216 1.807 . . . . 0.0 115.763 177.595 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 8.6 t0 -147.21 158.79 44.08 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.266 1.026 . . . . 0.0 108.905 178.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 6.3 t -59.79 -23.08 62.99 Favored 'General case' 0 N--CA 1.477 0.914 0 N-CA-C 115.061 1.504 . . . . 0.0 115.061 169.567 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 23.3 t0 -75.62 -33.75 60.54 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 124.512 1.125 . . . . 0.0 110.686 174.771 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 83.6 mt-10 -73.57 147.22 44.11 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.011 1.325 . . . . 0.0 113.345 -171.071 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -92.52 138.16 31.75 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 127.275 2.23 . . . . 0.0 109.825 175.123 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 14.0 tt0 -94.07 119.54 33.07 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 123.956 0.902 . . . . 0.0 111.316 175.492 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 59.5 mt -111.59 142.17 44.23 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 124.447 1.099 . . . . 0.0 111.76 179.272 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 16.0 tptp -106.18 142.19 36.29 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 124.737 1.215 . . . . 0.0 109.816 162.498 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -47.49 121.55 4.03 Favored 'General case' 0 CA--C 1.544 0.726 0 CA-C-O 121.657 0.742 . . . . 0.0 110.881 173.66 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 98.05 -3.81 60.51 Favored Glycine 0 CA--C 1.53 0.998 0 C-N-CA 125.191 1.377 . . . . 0.0 114.127 -178.715 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 82.0 m-20 -67.5 122.11 17.27 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 118.798 1.299 . . . . 0.0 114.228 174.854 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 2.3 t -74.89 135.19 27.84 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 CA-C-N 118.554 0.615 . . . . 0.0 111.552 165.889 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -125.31 121.5 60.69 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 C-N-CA 125.443 1.497 . . . . 0.0 111.744 177.494 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 548' ' ' LEU . . . . . 0.516 ' CD2' ' HE2' ' A' ' 524' ' ' LYS . 17.8 mt -77.13 99.28 5.33 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.609 1.164 . . . . 0.0 108.595 175.241 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 549' ' ' VAL . . . . . 0.46 HG21 ' CE1' ' A' ' 523' ' ' PHE . 2.8 t -60.58 128.48 21.79 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.955 0 N-CA-C 114.011 1.115 . . . . 0.0 114.011 171.142 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 8.7 pt -123.82 154.06 67.22 Favored Pre-proline 0 CA--C 1.547 0.852 0 C-N-CA 126.438 1.895 . . . . 0.0 109.749 177.485 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -70.6 148.9 60.66 Favored 'Trans proline' 0 N--CA 1.461 -0.429 0 C-N-CA 123.653 2.902 . . . . 0.0 110.129 173.862 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 46.7 m-85 -69.32 140.97 54.37 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 114.386 1.254 . . . . 0.0 114.386 176.075 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 553' ' ' GLN . . . . . 0.522 ' CD ' ' H ' ' A' ' 553' ' ' GLN . 0.0 OUTLIER -67.24 -20.33 65.66 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 128.146 2.578 . . . . 0.0 115.225 170.934 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 37.8 m-20 -151.39 154.34 33.49 Favored Pre-proline 0 CA--C 1.549 0.94 0 C-N-CA 125.524 1.529 . . . . 0.0 112.899 -175.426 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 555' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -73.71 -39.6 1.82 Allowed 'Trans proline' 0 CA--C 1.538 0.724 0 C-N-CA 123.712 2.941 . . . . 0.0 113.214 -179.746 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 26.0 pt-20 -82.49 -16.73 47.71 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.311 1.044 . . . . 0.0 113.761 -177.735 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 557' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -69.42 -24.74 63.88 Favored 'General case' 0 CA--C 1.543 0.689 0 O-C-N 121.474 -0.766 . . . . 0.0 112.031 168.878 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 50.6 tt0 -80.29 120.4 24.31 Favored 'General case' 0 C--O 1.234 0.25 0 C-N-CA 124.348 1.059 . . . . 0.0 112.722 -176.856 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 68.9 m-20 -94.24 151.82 19.16 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 125.328 1.451 . . . . 0.0 114.109 177.775 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 80.7 tt0 -82.28 119.16 23.75 Favored 'General case' 0 CA--C 1.541 0.597 0 O-C-N 121.053 -1.029 . . . . 0.0 111.907 -167.866 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 81.94 1.58 90.31 Favored Glycine 0 CA--C 1.543 1.797 0 C-N-CA 124.327 0.965 . . . . 0.0 114.834 -171.352 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 47.5 m95 -94.38 167.01 11.79 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 126.78 2.032 . . . . 0.0 113.253 176.45 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 22.7 mt -139.56 159.7 41.55 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 125.192 1.397 . . . . 0.0 110.887 169.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 46.0 ttm -115.17 143.84 44.6 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 125.501 1.52 . . . . 0.0 112.712 176.238 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -167.34 -173.44 35.53 Favored Glycine 0 CA--C 1.525 0.705 0 C-N-CA 124.057 0.837 . . . . 0.0 113.374 175.063 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 14.3 p -129.84 142.03 44.9 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 C-N-CA 125.836 1.655 . . . . 0.0 109.477 170.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 34.0 mtmt -59.04 132.61 54.56 Favored 'General case' 0 N--CA 1.467 0.421 0 O-C-N 121.428 -0.795 . . . . 0.0 111.929 176.189 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 18.3 tt0 -59.42 -42.61 92.23 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 118.473 -0.775 . . . . 0.0 111.124 178.758 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 34.0 t -65.31 -30.79 71.68 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 119.254 0.934 . . . . 0.0 111.963 178.699 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -70.6 -40.77 73.02 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 115.086 1.513 . . . . 0.0 115.086 173.1 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 64.3 t-105 -71.06 -30.42 66.56 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.217 1.407 . . . . 0.0 112.992 172.116 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 10.1 t-20 -67.52 -34.03 76.28 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 126.472 1.909 . . . . 0.0 111.585 172.161 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 35.4 mt-30 -80.77 -0.07 36.98 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 124.886 1.275 . . . . 0.0 113.44 168.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 9.0 m-70 53.78 37.43 26.31 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 126.061 1.744 . . . . 0.0 112.943 179.444 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 6.0 mtpm? -73.17 156.46 38.59 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 125.05 1.34 . . . . 0.0 110.854 175.882 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 12.1 pm0 -57.35 105.79 0.27 Allowed 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 125.038 1.335 . . . . 0.0 114.159 -167.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 55.2 tp -55.25 -48.15 74.39 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 124.505 1.122 . . . . 0.0 112.814 -170.139 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 1.2 pp20? -66.29 -16.45 64.05 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 125.253 1.421 . . . . 0.0 114.651 -175.401 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 32.3 mmtm -106.74 -37.51 6.38 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.681 1.193 . . . . 0.0 112.671 173.213 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 91.2 m -68.47 -28.57 67.15 Favored 'General case' 0 CA--C 1.537 0.479 0 N-CA-C 112.93 0.715 . . . . 0.0 112.93 -179.816 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 38.4 ptt85 -64.29 156.99 27.24 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 113.223 0.823 . . . . 0.0 113.223 176.757 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -169.85 171.04 43.18 Favored Glycine 0 N--CA 1.466 0.697 0 CA-C-N 115.765 -0.652 . . . . 0.0 114.52 176.354 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 17.4 m -90.44 137.16 22.17 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 C-N-CA 124.753 1.221 . . . . 0.0 112.236 172.403 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 48.0 p90 -135.15 155.29 79.07 Favored Pre-proline 0 C--O 1.241 0.629 0 C-N-CA 124.502 1.121 . . . . 0.0 112.932 176.832 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_endo -69.83 109.2 2.27 Favored 'Trans proline' 0 N--CA 1.455 -0.785 0 C-N-CA 121.773 1.649 . . . . 0.0 109.359 169.84 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 20.3 pt-20 -54.41 -23.5 16.08 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 124.16 0.984 . . . . 0.0 113.578 -179.805 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 9.7 p-10 -77.84 -11.29 59.87 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 127.151 2.181 . . . . 0.0 114.755 177.858 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 11.6 m-85 -75.67 -15.76 60.28 Favored 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 116.733 2.123 . . . . 0.0 116.733 162.294 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 589' ' ' THR . . . . . 0.569 HG22 ' HA ' ' A' ' 527' ' ' ALA . 40.8 p -120.16 174.34 6.56 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 125.495 1.518 . . . . 0.0 109.479 -174.596 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -122.34 139.33 53.95 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 123.871 0.869 . . . . 0.0 109.313 172.192 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.03 116.09 8.28 Favored 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 108.088 -1.079 . . . . 0.0 108.088 176.667 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 592' ' ' VAL . . . . . 0.477 HG23 ' HB2' ' A' ' 524' ' ' LYS . 4.6 m -96.43 151.92 38.35 Favored Pre-proline 0 N--CA 1.474 0.757 0 C-N-CA 124.623 1.169 . . . . 0.0 108.062 175.743 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 593' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo . . . . . 0 C--O 1.254 1.307 0 C-N-CA 124.026 3.151 . . . . 0.0 116.769 -159.067 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B 1728 ' ' SER . . . . . . . . . . . . . 46.8 t . . . . . 0 N--CA 1.473 0.71 0 N-CA-C 112.833 0.679 . . . . 0.0 112.833 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B 1729 ' ' THR . . . . . . . . . . . . . 1.4 t -70.52 -34.0 71.82 Favored 'General case' 0 N--CA 1.477 0.925 0 N-CA-C 117.476 2.399 . . . . 0.0 117.476 -176.948 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B 1730 ' ' VAL . . . . . . . . . . . . . 2.2 m -79.39 149.59 72.42 Favored Pre-proline 0 N--CA 1.477 0.888 0 C-N-CA 124.601 1.16 . . . . 0.0 112.86 177.654 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -61.92 161.97 23.85 Favored 'Trans proline' 0 CA--C 1.536 0.615 0 C-N-CA 123.409 2.739 . . . . 0.0 112.397 176.026 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 5.9 t -125.57 129.64 72.75 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.858 0 C-N-CA 124.777 1.231 . . . . 0.0 112.41 -176.624 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -69.34 141.52 91.24 Favored Pre-proline 0 CA--C 1.548 0.896 0 O-C-N 121.818 -0.551 . . . . 0.0 112.163 -177.112 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 3.6 Cg_endo -66.1 162.32 36.12 Favored 'Trans proline' 0 CA--C 1.541 0.864 0 C-N-CA 122.541 2.161 . . . . 0.0 112.596 172.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -53.99 162.15 4.23 Favored 'Trans proline' 0 CA--C 1.54 0.788 0 C-N-CA 123.195 2.597 . . . . 0.0 112.809 163.435 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B 1736 ' ' ARG . . . . . . . . . . . . . 27.7 mtp-105 -124.22 138.96 54.34 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 125.577 1.551 . . . . 0.0 111.183 174.121 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B 1737 ' ' ARG . . . . . . . . . . . . . 11.3 mmm-85 -72.94 -31.23 64.46 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 126.152 1.781 . . . . 0.0 110.071 176.506 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B 1738 ' ' ARG . . . . . . . . . . . . . 60.8 ttt180 49.18 81.68 0.05 Allowed 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 127.957 2.503 . . . . 0.0 113.568 163.122 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B 1739 ' ' ARG . . . . . . . . . . . . . 6.5 ppt_? -67.43 153.47 43.61 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 124.518 1.127 . . . . 0.0 112.692 178.081 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B 1740 ' ' GLY . . . . . . . . . . . . . . . -172.76 -139.15 2.76 Favored Glycine 0 CA--C 1.531 1.034 0 N-CA-C 115.114 0.806 . . . . 0.0 115.114 177.316 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B 1741 ' ' ARG . . . . . . . . . . . . . 31.8 tpt180 -63.71 130.76 45.54 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 127.083 2.153 . . . . 0.0 113.251 -173.604 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B 1742 ' ' ASN . . . . . . . . . . . . . 84.7 m-20 49.31 39.36 15.84 Favored 'General case' 0 CA--C 1.552 1.022 0 C-N-CA 125.719 1.608 . . . . 0.0 115.154 175.006 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B 1743 ' ' LEU . . . . . . . . . . . . . 64.6 tp -70.86 -25.81 62.98 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.384 1.074 . . . . 0.0 113.144 -179.503 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B 1744 ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.253 1.253 0 N-CA-C 117.583 2.438 . . . . 0.0 117.583 179.666 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 513' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 1.094 0 N-CA-C 110.44 -1.064 . . . . 0.0 110.44 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 514' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -66.11 140.05 58.2 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.341 0.656 . . . . 0.0 111.276 -176.613 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 12.6 tp -73.6 -42.95 60.85 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.498 179.438 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 516' ' ' ASP . . . . . . . . . . . . 0.305 5.3 p-10 -84.28 140.05 31.91 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 116.774 2.139 . . . . 0.0 116.774 175.529 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 517' ' ' LEU . . . . . 0.454 HD22 HD22 ' A' ' 548' ' ' LEU . 13.8 mt -129.48 158.69 72.53 Favored Pre-proline 0 CA--C 1.546 0.797 0 C-N-CA 125.813 1.645 . . . . 0.0 111.88 -165.512 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_endo -66.97 159.55 51.39 Favored 'Trans proline' 0 CA--C 1.544 0.99 0 C-N-CA 124.242 3.295 . . . . 0.0 113.932 -172.725 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_endo -61.13 121.72 10.08 Favored 'Trans proline' 0 CA--C 1.536 0.594 0 C-N-CA 123.707 2.938 . . . . 0.0 112.121 -173.298 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 77.54 4.22 84.31 Favored Glycine 0 CA--C 1.536 1.348 0 CA-C-O 117.081 -1.955 . . . . 0.0 116.27 -178.674 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 15.4 t80 -28.17 130.94 0.05 Allowed 'General case' 0 CA--C 1.547 0.851 0 N-CA-C 118.434 2.753 . . . . 0.0 118.434 178.008 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 48.5 mtm -99.41 -53.85 3.11 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 113.283 0.845 . . . . 0.0 113.283 -177.178 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 523' ' ' PHE . . . . . . . . . . . . . 17.8 p90 -166.52 165.96 16.54 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 126.439 1.896 . . . . 0.0 112.942 -172.683 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 524' ' ' LYS . . . . . 0.538 ' HE2' ' CD2' ' A' ' 548' ' ' LEU . 74.0 mttt -98.39 162.48 13.14 Favored 'General case' 0 CA--C 1.539 0.522 0 O-C-N 121.194 -0.942 . . . . 0.0 111.545 165.813 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 19.8 m -135.6 159.54 40.01 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 C-N-CA 126.546 1.938 . . . . 0.0 109.259 167.12 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 30.5 tt0 -122.04 126.86 49.43 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 124.052 0.941 . . . . 0.0 111.441 174.633 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 527' ' ' ALA . . . . . 0.485 ' HA ' HG22 ' A' ' 589' ' ' THR . . . -61.51 124.28 20.2 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 123.975 0.91 . . . . 0.0 111.629 179.253 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 38.8 mm-40 -87.38 -18.98 28.8 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 125.825 1.65 . . . . 0.0 112.232 176.751 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 97.0 m-70 -148.37 169.12 20.87 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 128.468 2.707 . . . . 0.0 109.84 -177.507 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -83.16 144.55 29.75 Favored 'General case' 0 CA--C 1.539 0.528 0 O-C-N 121.117 -0.989 . . . . 0.0 108.937 172.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 84.3 t80 -134.63 117.25 15.9 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 124.679 1.192 . . . . 0.0 113.234 173.489 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -86.95 116.08 24.77 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 114.335 1.235 . . . . 0.0 114.335 174.486 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -66.25 137.79 57.21 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 123.376 0.67 . . . . 0.0 112.013 177.615 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 13.4 t -112.43 -26.91 8.48 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 125.573 1.549 . . . . 0.0 114.012 175.807 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 27.4 t0 -93.64 149.98 20.79 Favored 'General case' 0 N--CA 1.473 0.721 0 O-C-N 120.857 -1.152 . . . . 0.0 108.323 175.069 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 536' ' ' THR . . . . . . . . . . . . 0.255 0.6 OUTLIER -59.2 -19.56 46.42 Favored 'General case' 0 N--CA 1.469 0.488 0 N-CA-C 115.998 1.851 . . . . 0.0 115.998 165.188 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 38.8 m-20 -82.19 -15.62 52.57 Favored 'General case' 0 CA--C 1.542 0.663 0 N-CA-C 117.625 2.454 . . . . 0.0 117.625 168.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 61.0 mt-10 -86.06 145.43 27.07 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 114.541 1.311 . . . . 0.0 114.541 -172.713 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -87.93 136.1 33.11 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 126.476 1.91 . . . . 0.0 110.415 174.369 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 38.9 tt0 -94.53 129.81 41.18 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 125.176 1.39 . . . . 0.0 110.83 177.478 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 81.4 mt -124.85 154.02 41.68 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 125.112 1.365 . . . . 0.0 112.146 -178.316 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 6.3 tmtm? -126.48 144.27 50.91 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 125.873 1.669 . . . . 0.0 108.223 168.739 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -47.84 117.74 2.0 Favored 'General case' 0 CA--C 1.543 0.709 0 CA-C-O 122.422 1.105 . . . . 0.0 112.267 177.598 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 103.96 -5.14 46.11 Favored Glycine 0 CA--C 1.529 0.968 0 C-N-CA 127.179 2.323 . . . . 0.0 113.577 178.287 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 75.4 m-20 -73.71 127.68 33.45 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 118.945 1.372 . . . . 0.0 114.436 -173.603 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 2.0 t -76.98 135.18 27.15 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 N-CA-C 112.473 0.546 . . . . 0.0 112.473 173.897 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 1.2 t -126.48 122.88 62.08 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 C-N-CA 125.199 1.4 . . . . 0.0 111.81 177.272 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 548' ' ' LEU . . . . . 0.538 ' CD2' ' HE2' ' A' ' 524' ' ' LYS . 17.5 mt -78.03 99.61 6.17 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 124.488 1.115 . . . . 0.0 108.636 174.56 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 549' ' ' VAL . . . . . . . . . . . . . 4.6 t -62.5 128.61 24.57 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.032 0 N-CA-C 113.666 0.987 . . . . 0.0 113.666 171.497 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 10.9 pt -119.45 153.68 53.94 Favored Pre-proline 0 N--CA 1.47 0.552 0 C-N-CA 126.138 1.775 . . . . 0.0 109.817 179.877 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 77.4 Cg_endo -67.11 142.73 62.48 Favored 'Trans proline' 0 N--CA 1.458 -0.596 0 C-N-CA 122.823 2.349 . . . . 0.0 110.443 175.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 552' ' ' PHE . . . . . 0.427 ' CE1' ' HA ' ' A' ' 558' ' ' GLN . 39.1 m-85 -64.35 140.43 58.87 Favored 'General case' 0 CA--C 1.53 0.179 0 N-CA-C 117.288 2.329 . . . . 0.0 117.288 -177.087 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 553' ' ' GLN . . . . . . . . . . . . . 19.5 pt20 -90.7 -15.41 30.36 Favored 'General case' 0 CA--C 1.54 0.565 0 N-CA-C 116.262 1.949 . . . . 0.0 116.262 -169.189 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -152.83 156.89 33.24 Favored Pre-proline 0 CA--C 1.544 0.741 0 C-N-CA 124.532 1.133 . . . . 0.0 110.248 168.459 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 555' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -70.86 -33.62 12.15 Favored 'Trans proline' 0 CA--C 1.535 0.529 0 C-N-CA 123.303 2.669 . . . . 0.0 112.01 -176.397 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -72.92 -14.54 61.48 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 113.211 0.819 . . . . 0.0 113.211 173.774 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 557' ' ' GLU . . . . . . . . . . . . . 65.6 mm-40 -85.77 -25.73 26.22 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 124.949 1.3 . . . . 0.0 112.6 179.515 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 558' ' ' GLN . . . . . 0.427 ' HA ' ' CE1' ' A' ' 552' ' ' PHE . 7.0 tt0 -82.44 107.41 15.08 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-O 122.035 0.921 . . . . 0.0 112.683 178.503 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . 0.296 9.1 m-20 -96.67 138.92 33.51 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 116.744 2.128 . . . . 0.0 116.744 172.775 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 17.3 tp10 -68.05 124.62 23.92 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.695 1.198 . . . . 0.0 111.007 -177.73 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 83.51 -2.99 86.42 Favored Glycine 0 CA--C 1.535 1.341 0 C-N-CA 125.134 1.349 . . . . 0.0 115.173 -171.409 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 50.2 m95 -98.93 161.3 13.7 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 125.312 1.445 . . . . 0.0 112.348 172.891 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 13.1 mt -137.31 154.94 49.98 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 124.688 1.195 . . . . 0.0 110.213 172.263 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 56.5 ttm -116.23 141.14 48.53 Favored 'General case' 0 N--CA 1.464 0.229 0 C-N-CA 124.717 1.207 . . . . 0.0 111.537 178.172 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -173.1 -171.87 38.16 Favored Glycine 0 CA--C 1.522 0.5 0 C-N-CA 123.341 0.496 . . . . 0.0 113.028 -179.836 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 13.2 p -133.17 140.97 45.9 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.634 0 C-N-CA 125.76 1.624 . . . . 0.0 108.916 171.943 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 35.4 mtmt -58.48 137.85 57.08 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 121.284 -0.885 . . . . 0.0 111.16 176.35 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -60.36 -41.76 94.39 Favored 'General case' 0 C--O 1.22 -0.45 0 CA-C-O 118.9 -0.571 . . . . 0.0 110.707 174.661 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 32.1 t -67.91 -20.18 65.07 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 119.151 0.887 . . . . 0.0 113.062 177.24 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 33.8 m-20 -78.57 -44.92 22.99 Favored 'General case' 0 CA--C 1.541 0.63 0 O-C-N 120.642 -1.287 . . . . 0.0 114.351 168.554 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 66.0 t-105 -72.63 -33.84 66.91 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 125.907 1.683 . . . . 0.0 113.618 177.898 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 44.3 t-20 -71.79 -21.64 61.69 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 127.063 2.145 . . . . 0.0 111.848 172.628 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 75.4 mt-30 -91.2 1.19 57.28 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.972 1.309 . . . . 0.0 113.544 164.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 93.4 m-70 59.68 28.75 18.24 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 126.782 2.033 . . . . 0.0 114.854 170.484 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 75.0 mttt -68.34 163.28 23.42 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 126.144 1.778 . . . . 0.0 111.855 179.245 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 4.8 pm0 -54.72 111.44 0.81 Allowed 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 113.653 0.983 . . . . 0.0 113.653 -175.143 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 50.5 tp -64.0 -34.71 78.63 Favored 'General case' 0 N--CA 1.469 0.504 0 O-C-N 120.659 -1.276 . . . . 0.0 111.223 -169.444 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 32.5 mp0 -72.86 -17.55 61.52 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 125.545 1.538 . . . . 0.0 113.737 -174.415 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 50.1 mmtt -118.91 -25.09 6.37 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 125.334 1.454 . . . . 0.0 114.256 179.223 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 98.0 m -71.32 -33.0 69.27 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 118.526 0.603 . . . . 0.0 112.128 169.211 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 15.1 ptp180 -63.25 165.14 7.77 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-O 121.888 0.851 . . . . 0.0 112.886 173.761 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -178.12 178.63 48.56 Favored Glycine 0 CA--C 1.523 0.531 0 CA-C-N 115.034 -0.985 . . . . 0.0 112.593 171.799 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 27.5 m -93.66 141.48 14.73 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.461 0 C-N-CA 123.758 0.823 . . . . 0.0 110.697 167.293 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 43.8 p90 -134.04 154.48 80.24 Favored Pre-proline 0 C--O 1.24 0.563 0 C-N-CA 124.997 1.319 . . . . 0.0 112.371 175.415 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -68.44 112.48 2.83 Favored 'Trans proline' 0 N--CA 1.459 -0.53 0 C-N-CA 121.86 1.707 . . . . 0.0 109.214 172.398 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 19.5 pt-20 -56.87 -26.98 59.82 Favored 'General case' 0 N--CA 1.476 0.844 0 O-C-N 121.252 -0.905 . . . . 0.0 112.428 -176.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 6.7 p-10 -64.81 -23.73 67.33 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 125.782 1.633 . . . . 0.0 113.594 177.023 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 23.0 m-85 -69.86 -11.63 61.01 Favored 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 117.074 2.25 . . . . 0.0 117.074 166.577 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 589' ' ' THR . . . . . 0.485 HG22 ' HA ' ' A' ' 527' ' ' ALA . 71.5 p -128.53 174.59 9.24 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 125.603 1.561 . . . . 0.0 110.546 -176.391 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -134.37 145.81 49.32 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 123.612 0.765 . . . . 0.0 110.711 169.596 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -58.83 135.14 57.42 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 124.959 1.303 . . . . 0.0 110.804 175.542 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 592' ' ' VAL . . . . . 0.484 HG23 ' HB2' ' A' ' 524' ' ' LYS . 3.1 m -123.35 155.68 64.84 Favored Pre-proline 0 CA--C 1.544 0.745 0 C-N-CA 126.013 1.725 . . . . 0.0 107.762 173.851 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 593' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo . . . . . 0 C--O 1.251 1.15 0 C-N-CA 123.62 2.88 . . . . 0.0 114.976 -169.406 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B 1728 ' ' SER . . . . . . . . . . . . . 30.6 t . . . . . 0 N--CA 1.474 0.73 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B 1729 ' ' THR . . . . . . . . . . . . 0.255 0.2 OUTLIER -133.31 -2.84 3.09 Favored 'General case' 0 N--CA 1.48 1.051 0 N-CA-C 117.486 2.402 . . . . 0.0 117.486 -156.844 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B 1730 ' ' VAL . . . . . . . . . . . . . 16.9 m -141.06 133.88 14.36 Favored Pre-proline 0 CA--C 1.543 0.685 0 C-N-CA 125.827 1.651 . . . . 0.0 108.844 162.365 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -70.3 173.98 10.65 Favored 'Trans proline' 0 CA--C 1.54 0.798 0 C-N-CA 123.732 2.955 . . . . 0.0 113.511 179.432 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 7.1 t -134.26 129.54 53.49 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 C-N-CA 125.796 1.638 . . . . 0.0 112.123 -176.53 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -69.55 133.79 88.78 Favored Pre-proline 0 CA--C 1.555 1.161 0 O-C-N 121.558 -0.714 . . . . 0.0 112.596 -177.04 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -80.05 164.06 22.55 Favored 'Trans proline' 0 CA--C 1.547 1.161 0 C-N-CA 123.274 2.649 . . . . 0.0 113.353 -177.888 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 77.1 Cg_exo -56.21 149.45 54.51 Favored 'Trans proline' 0 CA--C 1.54 0.79 0 C-N-CA 123.716 2.944 . . . . 0.0 114.907 -178.764 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B 1736 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -129.02 169.84 14.21 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 125.876 1.67 . . . . 0.0 111.566 177.499 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B 1737 ' ' ARG . . . . . . . . . . . . . 75.9 mtp85 -118.38 171.89 7.84 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 125.66 1.584 . . . . 0.0 114.0 -169.896 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B 1738 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.17 158.66 34.85 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 124.183 0.993 . . . . 0.0 113.433 -179.604 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B 1739 ' ' ARG . . . . . . . . . . . . . 5.4 tpp180 -147.48 149.92 33.59 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 124.321 1.048 . . . . 0.0 113.664 -162.971 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B 1740 ' ' GLY . . . . . . . . . . . . . . . 74.72 165.22 13.19 Favored Glycine 0 CA--C 1.534 1.245 0 N-CA-C 116.942 1.537 . . . . 0.0 116.942 157.23 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B 1741 ' ' ARG . . . . . . . . . . . . . 7.6 tpp85 -149.38 35.3 0.72 Allowed 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 125.266 1.426 . . . . 0.0 112.376 176.708 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B 1742 ' ' ASN . . . . . . . . . . . . . 21.5 p30 -77.7 5.99 8.26 Favored 'General case' 0 CA--C 1.553 1.064 0 N-CA-C 116.559 2.059 . . . . 0.0 116.559 -172.593 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B 1743 ' ' LEU . . . . . . . . . . . . . 1.4 pt? -61.48 149.4 38.84 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 119.55 1.068 . . . . 0.0 113.57 172.848 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B 1744 ' ' THR . . . . . . . . . . . . 0.277 0.2 OUTLIER . . . . . 0 C--O 1.252 1.21 0 N-CA-C 117.979 2.585 . . . . 0.0 117.979 -173.918 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 513' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.391 0 N-CA-C 111.996 -0.442 . . . . 0.0 111.996 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 514' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -100.58 152.48 20.37 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 126.634 1.974 . . . . 0.0 112.194 177.103 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 65.8 mt -99.43 -24.42 14.8 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.293 1.037 . . . . 0.0 113.395 177.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 516' ' ' ASP . . . . . . . . . . . . . 46.3 p-10 -150.34 179.41 8.15 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.253 1.421 . . . . 0.0 113.689 -173.097 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 517' ' ' LEU . . . . . 0.448 HD22 HD22 ' A' ' 548' ' ' LEU . 10.3 mt -107.08 166.37 11.19 Favored Pre-proline 0 CA--C 1.55 0.972 0 C-N-CA 126.839 2.055 . . . . 0.0 111.966 173.649 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -73.15 160.51 45.24 Favored 'Trans proline' 0 CA--C 1.539 0.757 0 C-N-CA 123.677 2.918 . . . . 0.0 113.394 -174.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -62.81 135.0 49.66 Favored 'Trans proline' 0 N--CA 1.459 -0.547 0 C-N-CA 123.353 2.702 . . . . 0.0 110.228 178.867 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 76.82 -1.34 62.93 Favored Glycine 0 CA--C 1.534 1.254 0 CA-C-O 117.295 -1.836 . . . . 0.0 115.508 -178.139 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 49.0 t80 -41.29 131.69 2.73 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 120.683 2.241 . . . . 0.0 115.741 -177.317 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 65.6 mtm -105.52 -56.27 2.2 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 123.269 0.628 . . . . 0.0 111.595 179.547 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 523' ' ' PHE . . . . . . . . . . . . . 21.9 p90 -161.33 168.24 24.31 Favored 'General case' 0 C--O 1.224 -0.239 0 C-N-CA 125.88 1.672 . . . . 0.0 113.35 -173.417 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 524' ' ' LYS . . . . . 0.545 ' HE2' ' CD2' ' A' ' 548' ' ' LEU . 41.9 mttt -98.44 163.58 12.63 Favored 'General case' 0 N--CA 1.469 0.506 0 O-C-N 121.223 -0.923 . . . . 0.0 112.155 165.371 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 13.7 m -133.91 158.48 42.41 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 C-N-CA 126.706 2.002 . . . . 0.0 109.171 164.228 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 54.8 tt0 -122.0 131.57 54.07 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 119.12 0.873 . . . . 0.0 112.034 170.701 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 527' ' ' ALA . . . . . 0.449 ' HA ' HG22 ' A' ' 589' ' ' THR . . . -64.15 125.38 24.34 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 121.115 -0.991 . . . . 0.0 112.68 179.166 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 58.8 mm-40 -89.54 -23.94 21.88 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 125.791 1.636 . . . . 0.0 112.024 174.04 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 96.6 m-70 -141.28 162.53 35.27 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 126.768 2.027 . . . . 0.0 110.699 -175.323 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -80.67 128.1 33.24 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 125.68 1.592 . . . . 0.0 113.825 176.782 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 86.2 t80 -129.27 115.67 17.97 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.521 1.129 . . . . 0.0 113.933 179.18 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -79.36 121.84 25.63 Favored 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 116.139 1.904 . . . . 0.0 116.139 175.365 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -71.33 124.49 24.67 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 118.723 0.692 . . . . 0.0 111.455 175.533 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 9.8 t -129.41 37.93 3.94 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 127.095 2.158 . . . . 0.0 110.089 -177.399 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 18.6 t0 -161.78 158.2 25.35 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.804 1.642 . . . . 0.0 107.67 166.211 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 3.1 t -62.73 -21.32 65.71 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 114.982 1.475 . . . . 0.0 114.982 164.539 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 29.0 t0 -74.95 -30.07 61.12 Favored 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 125.343 1.457 . . . . 0.0 110.364 173.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 67.7 mt-10 -84.64 154.74 22.35 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 115.515 1.672 . . . . 0.0 115.515 -164.872 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -102.88 134.04 46.96 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 127.449 2.3 . . . . 0.0 110.217 174.118 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 29.5 tt0 -87.63 128.72 35.27 Favored 'General case' 0 CA--C 1.537 0.457 0 O-C-N 121.483 -0.761 . . . . 0.0 110.965 174.661 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 78.2 mt -120.82 146.76 46.2 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 123.971 0.908 . . . . 0.0 111.088 178.53 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 7.3 tmtm? -121.86 144.94 48.54 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 125.447 1.499 . . . . 0.0 108.693 170.47 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -55.24 109.81 0.59 Allowed 'General case' 0 CA--C 1.548 0.871 0 CA-C-O 121.601 0.715 . . . . 0.0 111.622 -177.74 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 118.1 -11.13 13.24 Favored Glycine 0 CA--C 1.534 1.242 0 C-N-CA 126.857 2.17 . . . . 0.0 114.652 -175.539 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 85.9 m-20 -70.38 120.17 15.64 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 119.604 1.702 . . . . 0.0 114.017 -173.795 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 1.8 t -72.39 135.6 27.45 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.088 0 CA-C-N 119.051 0.841 . . . . 0.0 112.547 167.22 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 1.1 t -126.93 122.49 60.49 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.455 0 C-N-CA 126.236 1.814 . . . . 0.0 111.708 177.635 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 548' ' ' LEU . . . . . 0.545 ' CD2' ' HE2' ' A' ' 524' ' ' LYS . 19.1 mt -77.92 101.45 6.84 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 124.845 1.258 . . . . 0.0 108.787 174.548 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 549' ' ' VAL . . . . . . . . . . . . . 5.0 t -63.6 131.42 29.16 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.076 0 N-CA-C 114.252 1.204 . . . . 0.0 114.252 173.497 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 3.8 pt -130.51 154.53 81.65 Favored Pre-proline 0 CA--C 1.547 0.854 0 C-N-CA 127.027 2.131 . . . . 0.0 109.318 177.3 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo -71.9 143.85 41.92 Favored 'Trans proline' 0 CA--C 1.536 0.62 0 C-N-CA 123.442 2.762 . . . . 0.0 110.989 174.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 19.3 m-85 -56.52 153.1 10.61 Favored 'General case' 0 N--CA 1.466 0.344 0 N-CA-C 117.739 2.496 . . . . 0.0 117.739 -170.604 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 553' ' ' GLN . . . . . . . . . . . . . 7.4 pt20 -61.65 -29.77 70.28 Favored 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 113.827 1.047 . . . . 0.0 113.827 175.134 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 9.7 m-20 -156.81 154.96 27.76 Favored Pre-proline 0 CA--C 1.545 0.779 0 CA-C-N 119.51 1.05 . . . . 0.0 113.024 173.374 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 555' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -71.65 -29.06 16.48 Favored 'Trans proline' 0 CA--C 1.54 0.82 0 C-N-CA 123.932 3.088 . . . . 0.0 113.364 178.055 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 26.0 pt-20 -72.71 -26.13 61.48 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 124.04 0.936 . . . . 0.0 112.145 170.146 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 557' ' ' GLU . . . . . . . . . . . . . 34.6 mm-40 -78.94 -28.92 43.81 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 125.657 1.583 . . . . 0.0 114.603 178.3 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 38.3 tt0 -67.13 127.67 33.49 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 123.311 0.645 . . . . 0.0 112.685 -175.17 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -101.06 144.92 29.4 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 124.673 1.189 . . . . 0.0 108.496 -173.583 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 43.0 tp10 -73.64 124.36 25.8 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.407 1.083 . . . . 0.0 111.787 -174.694 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 82.01 2.07 90.47 Favored Glycine 0 CA--C 1.54 1.646 0 C-N-CA 124.374 0.987 . . . . 0.0 115.273 -175.844 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 45.2 m95 -97.9 165.98 11.67 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 126.132 1.773 . . . . 0.0 113.427 176.3 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 14.7 mt -133.46 161.28 34.98 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 124.702 1.201 . . . . 0.0 110.654 168.239 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 50.6 ttm -119.29 144.51 46.76 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 125.362 1.465 . . . . 0.0 111.52 176.21 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -173.68 -173.43 39.88 Favored Glycine 0 CA--C 1.527 0.801 0 C-N-CA 124.275 0.941 . . . . 0.0 113.399 177.384 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 13.9 p -130.92 141.73 45.42 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 C-N-CA 126.265 1.826 . . . . 0.0 108.907 172.76 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 26.7 mtmt -61.35 139.44 58.18 Favored 'General case' 0 N--CA 1.468 0.459 0 O-C-N 120.867 -1.146 . . . . 0.0 111.771 177.9 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 20.8 tt0 -61.77 -42.31 98.82 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-O 118.288 -0.863 . . . . 0.0 111.17 178.639 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 24.6 t -65.43 -30.55 71.36 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-N 119.36 0.982 . . . . 0.0 112.61 177.041 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 89.0 m-20 -67.28 -43.58 81.41 Favored 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 114.555 1.317 . . . . 0.0 114.555 171.691 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 64.3 t-105 -71.91 -26.69 62.41 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.885 1.274 . . . . 0.0 113.285 172.694 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 7.3 t-20 -74.47 -31.15 62.13 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.862 1.665 . . . . 0.0 111.093 171.792 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 64.5 mm-40 -77.41 -7.08 55.57 Favored 'General case' 0 N--CA 1.477 0.894 0 CA-C-N 119.09 0.859 . . . . 0.0 113.23 166.799 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 12.1 m-70 63.24 32.09 15.1 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 127.284 2.234 . . . . 0.0 112.728 178.335 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 28.6 mttm -63.27 157.29 23.15 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 125.073 1.349 . . . . 0.0 112.649 179.53 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 3.9 pm0 -52.81 101.19 0.04 OUTLIER 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 124.865 1.266 . . . . 0.0 113.055 -179.448 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 26.4 tp -59.08 -47.95 83.39 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 124.165 0.986 . . . . 0.0 111.351 -163.428 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 21.0 mp0 -73.17 -18.55 61.25 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 115.461 -0.791 . . . . 0.0 112.098 -168.377 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 57.3 tptt -95.56 -36.02 11.43 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 124.69 1.196 . . . . 0.0 112.92 170.022 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 6.3 t -77.9 -22.27 49.95 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 124.112 0.965 . . . . 0.0 112.901 -174.164 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 32.0 ptt180 -64.26 163.11 13.42 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.802 1.241 . . . . 0.0 112.327 171.94 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -170.56 173.65 44.43 Favored Glycine 0 CA--C 1.526 0.769 0 C-N-CA 123.874 0.749 . . . . 0.0 113.95 175.654 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 19.5 m -91.55 144.16 9.78 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 C-N-CA 124.641 1.176 . . . . 0.0 112.064 170.704 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 47.5 p90 -140.9 153.74 67.8 Favored Pre-proline 0 CA--C 1.543 0.684 0 C-N-CA 124.782 1.233 . . . . 0.0 113.202 177.094 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -65.79 112.16 2.13 Favored 'Trans proline' 0 C--N 1.347 0.484 0 C-N-CA 122.195 1.93 . . . . 0.0 109.543 169.906 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 21.9 pt-20 -54.37 -31.14 54.0 Favored 'General case' 0 N--CA 1.473 0.721 0 O-C-N 121.735 -0.603 . . . . 0.0 112.243 -178.388 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 9.7 p-10 -68.46 -17.36 64.17 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 126.642 1.977 . . . . 0.0 114.318 -179.86 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 19.4 m-85 -72.13 -11.08 60.58 Favored 'General case' 0 CA--C 1.534 0.365 0 N-CA-C 116.269 1.951 . . . . 0.0 116.269 164.369 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 589' ' ' THR . . . . . 0.449 HG22 ' HA ' ' A' ' 527' ' ' ALA . 71.5 p -129.85 166.42 20.0 Favored 'General case' 0 C--O 1.234 0.237 0 C-N-CA 125.809 1.644 . . . . 0.0 112.037 -173.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -122.93 134.34 54.36 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 123.547 0.739 . . . . 0.0 110.377 176.941 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.84 123.93 21.92 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 125.808 1.643 . . . . 0.0 109.555 -177.548 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 592' ' ' VAL . . . . . . . . . . . . . 6.9 m -113.76 153.4 45.98 Favored Pre-proline 0 CA--C 1.552 1.034 0 C-N-CA 124.854 1.262 . . . . 0.0 109.306 -177.211 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 593' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_endo . . . . . 0 C--O 1.253 1.264 0 C-N-CA 125.29 3.994 . . . . 0.0 115.532 -169.835 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B 1728 ' ' SER . . . . . . . . . . . . . 35.9 p . . . . . 0 N--CA 1.472 0.632 0 CA-C-O 119.374 -0.346 . . . . 0.0 111.23 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B 1729 ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -81.92 -29.05 32.48 Favored 'General case' 0 N--CA 1.477 0.917 0 N-CA-C 117.095 2.257 . . . . 0.0 117.095 -176.793 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B 1730 ' ' VAL . . . . . . . . . . . . . 12.7 m -77.14 151.09 81.31 Favored Pre-proline 0 N--CA 1.476 0.843 0 C-N-CA 124.463 1.105 . . . . 0.0 113.159 -177.491 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 70.5 Cg_endo -68.49 175.46 6.96 Favored 'Trans proline' 0 CA--C 1.543 0.931 0 C-N-CA 123.233 2.622 . . . . 0.0 113.405 169.857 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 15.6 t -124.75 137.88 55.96 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 C-N-CA 125.159 1.384 . . . . 0.0 111.924 175.476 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -68.44 143.27 95.28 Favored Pre-proline 0 CA--C 1.554 1.112 0 O-C-N 121.537 -0.727 . . . . 0.0 112.631 179.086 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 26.6 Cg_endo -76.87 164.52 29.84 Favored 'Trans proline' 0 CA--C 1.548 1.2 0 C-N-CA 122.893 2.395 . . . . 0.0 113.51 177.221 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -70.28 139.19 37.85 Favored 'Trans proline' 0 CA--C 1.541 0.849 0 C-N-CA 123.455 2.77 . . . . 0.0 112.131 176.44 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B 1736 ' ' ARG . . . . . . . . . . . . . 23.5 mtp180 -97.74 174.57 6.54 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 126.457 1.903 . . . . 0.0 115.531 -170.71 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B 1737 ' ' ARG . . . . . . . . . . . . . 25.0 mtp85 54.94 79.85 0.14 Allowed 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 127.366 2.266 . . . . 0.0 112.823 172.348 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B 1738 ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -74.4 -26.68 60.24 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 127.56 2.344 . . . . 0.0 114.101 -176.411 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B 1739 ' ' ARG . . . . . . . . . . . . . 10.8 ptt85 -35.89 122.55 0.68 Allowed 'General case' 0 N--CA 1.484 1.243 0 N-CA-C 116.873 2.175 . . . . 0.0 116.873 -169.185 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B 1740 ' ' GLY . . . . . . . . . . . . . . . 172.77 -149.55 11.56 Favored Glycine 0 CA--C 1.534 1.239 0 C-N-CA 125.656 1.598 . . . . 0.0 112.72 -178.557 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B 1741 ' ' ARG . . . . . . . . . . . . . 48.2 ttt-85 -43.55 130.63 5.21 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 126.015 1.726 . . . . 0.0 112.907 174.565 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B 1742 ' ' ASN . . . . . . . . . . . . . 34.4 t30 -76.09 142.54 41.69 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 118.433 0.561 . . . . 0.0 110.987 168.793 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B 1743 ' ' LEU . . . . . . . . . . . . . 4.4 pp -129.21 153.7 47.49 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.529 1.131 . . . . 0.0 112.597 174.461 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B 1744 ' ' THR . . . . . . . . . . . . . 2.3 m . . . . . 0 C--O 1.253 1.27 0 C-N-CA 127.142 2.177 . . . . 0.0 114.24 176.01 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 513' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.784 0 N-CA-C 110.847 -0.901 . . . . 0.0 110.847 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 514' ' ' ARG . . . . . . . . . . . . . 3.8 ppt_? -63.62 165.37 8.26 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 126.879 2.071 . . . . 0.0 114.044 -179.388 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 88.6 mt -104.65 -56.28 2.21 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 126.18 1.792 . . . . 0.0 110.058 163.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 516' ' ' ASP . . . . . . . . . . . . . 61.3 m-20 -97.59 146.47 25.26 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 117.033 2.235 . . . . 0.0 117.033 -176.497 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 517' ' ' LEU . . . . . 0.474 HD22 HD22 ' A' ' 548' ' ' LEU . 11.7 mt -79.14 163.91 57.41 Favored Pre-proline 0 CA--C 1.553 1.093 0 C-N-CA 124.451 1.101 . . . . 0.0 111.069 161.153 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -67.97 160.07 50.15 Favored 'Trans proline' 0 CA--C 1.541 0.842 0 C-N-CA 123.671 2.914 . . . . 0.0 113.222 -177.078 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -62.61 134.15 46.12 Favored 'Trans proline' 0 CA--C 1.535 0.562 0 C-N-CA 123.05 2.5 . . . . 0.0 111.037 -177.598 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 74.42 -2.1 47.7 Favored Glycine 0 CA--C 1.535 1.337 0 CA-C-O 117.628 -1.651 . . . . 0.0 115.751 -178.675 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 31.3 t80 -31.69 123.7 0.27 Allowed 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 117.827 2.528 . . . . 0.0 117.827 -176.795 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 46.2 mtm -94.81 -53.1 3.98 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 112.413 0.523 . . . . 0.0 112.413 -176.095 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 523' ' ' PHE . . . . . 0.402 ' CE2' HG21 ' A' ' 549' ' ' VAL . 28.1 p90 -169.55 174.26 5.99 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 126.556 1.943 . . . . 0.0 112.872 -173.591 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 524' ' ' LYS . . . . . 0.451 ' HG2' HD23 ' A' ' 548' ' ' LEU . 50.9 mttt -106.58 163.81 12.58 Favored 'General case' 0 N--CA 1.47 0.543 0 O-C-N 120.818 -1.176 . . . . 0.0 112.653 169.207 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 12.5 m -133.3 160.91 42.16 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.925 0 C-N-CA 126.626 1.97 . . . . 0.0 110.065 165.413 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 25.6 tt0 -124.5 127.37 47.35 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 119.709 1.14 . . . . 0.0 112.919 172.733 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 527' ' ' ALA . . . . . 0.492 ' HA ' HG22 ' A' ' 589' ' ' THR . . . -64.6 123.71 19.98 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.618 1.167 . . . . 0.0 112.738 -178.45 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 35.5 mm-40 -89.68 -25.35 21.27 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 125.426 1.49 . . . . 0.0 111.87 175.276 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 94.3 m-70 -138.62 164.66 28.91 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 127.745 2.418 . . . . 0.0 110.121 179.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -87.73 138.64 31.29 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 107.092 -1.447 . . . . 0.0 107.092 177.098 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 66.9 t80 -127.43 115.74 19.38 Favored 'General case' 0 C--N 1.332 -0.187 0 C-N-CA 125.586 1.555 . . . . 0.0 113.648 -179.194 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -84.15 128.45 34.57 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 114.722 1.379 . . . . 0.0 114.722 -177.56 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -72.11 108.64 5.41 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 121.778 0.799 . . . . 0.0 111.139 -179.309 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 12.3 t -80.53 -17.97 49.91 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 114.388 1.255 . . . . 0.0 114.388 -177.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 24.8 m-20 -148.57 168.84 21.71 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 127.205 2.202 . . . . 0.0 114.9 -171.262 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 2.0 t -61.06 -34.78 75.43 Favored 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 117.012 2.227 . . . . 0.0 117.012 -173.284 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 45.3 m-20 -81.34 -15.21 56.04 Favored 'General case' 0 CA--C 1.539 0.558 0 N-CA-C 114.971 1.471 . . . . 0.0 114.971 177.643 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 24.3 mp0 -83.71 134.37 34.76 Favored 'General case' 0 CA--C 1.543 0.707 0 O-C-N 120.873 -1.142 . . . . 0.0 113.849 -166.412 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -83.9 128.63 34.68 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.922 1.689 . . . . 0.0 110.442 178.93 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 8.6 tt0 -90.1 132.41 35.44 Favored 'General case' 0 CA--C 1.537 0.48 0 O-C-N 121.667 -0.645 . . . . 0.0 111.932 177.827 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 73.1 mt -123.68 146.43 48.24 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.722 1.209 . . . . 0.0 112.643 -174.741 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -114.3 141.17 47.93 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 125.05 1.34 . . . . 0.0 110.126 170.272 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -56.2 104.91 0.16 Allowed 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 123.75 0.82 . . . . 0.0 111.895 179.622 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 125.38 -12.74 7.48 Favored Glycine 0 CA--C 1.532 1.147 0 C-N-CA 126.616 2.055 . . . . 0.0 114.296 -174.161 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 90.0 m-20 -74.14 125.43 28.33 Favored 'General case' 0 C--O 1.231 0.12 0 N-CA-C 115.227 1.565 . . . . 0.0 115.227 -173.183 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 2.6 t -73.85 134.33 29.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 C-N-CA 122.921 0.488 . . . . 0.0 111.394 167.041 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 1.4 t -121.92 121.6 64.59 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.593 0 C-N-CA 124.9 1.28 . . . . 0.0 111.308 174.108 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 548' ' ' LEU . . . . . 0.474 HD22 HD22 ' A' ' 517' ' ' LEU . 18.3 mt -77.17 100.22 5.7 Favored 'General case' 0 CA--C 1.539 0.525 0 N-CA-C 108.055 -1.091 . . . . 0.0 108.055 175.895 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 549' ' ' VAL . . . . . 0.402 HG21 ' CE2' ' A' ' 523' ' ' PHE . 4.1 t -62.03 129.31 24.96 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.92 0 N-CA-C 113.652 0.982 . . . . 0.0 113.652 171.572 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 8.3 pt -123.69 154.67 66.9 Favored Pre-proline 0 CA--C 1.54 0.592 0 C-N-CA 125.965 1.706 . . . . 0.0 109.447 179.581 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -65.39 142.28 71.71 Favored 'Trans proline' 0 N--CA 1.458 -0.593 0 C-N-CA 122.711 2.274 . . . . 0.0 110.026 174.686 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 34.5 m-85 -58.33 140.0 54.26 Favored 'General case' 0 C--O 1.235 0.335 0 N-CA-C 116.807 2.151 . . . . 0.0 116.807 -175.555 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 553' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -61.12 -27.69 68.57 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 114.6 1.333 . . . . 0.0 114.6 178.093 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 6.4 m-20 -156.73 153.15 23.85 Favored Pre-proline 0 CA--C 1.542 0.652 0 C-N-CA 125.876 1.67 . . . . 0.0 111.73 174.225 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 555' ' ' PRO . . . . . . . . . . . . . 62.8 Cg_endo -68.09 -33.25 25.81 Favored 'Trans proline' 0 CA--C 1.537 0.637 0 C-N-CA 123.592 2.861 . . . . 0.0 112.761 -177.326 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 26.5 pt-20 -76.71 -16.96 59.37 Favored 'General case' 0 CA--C 1.544 0.713 0 O-C-N 121.393 -0.817 . . . . 0.0 113.074 174.053 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 557' ' ' GLU . . . . . . . . . . . . . 55.4 mm-40 -78.94 -17.75 54.97 Favored 'General case' 0 CA--C 1.545 0.766 0 O-C-N 121.165 -0.96 . . . . 0.0 113.005 176.167 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 49.1 tt0 -76.79 129.22 35.97 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 125.299 1.44 . . . . 0.0 111.988 174.694 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -114.73 149.77 36.34 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 126.189 1.795 . . . . 0.0 113.083 171.517 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 57.0 tt0 -69.9 122.99 20.37 Favored 'General case' 0 CA--C 1.538 0.49 0 O-C-N 121.142 -0.974 . . . . 0.0 111.436 -173.493 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 85.43 -2.23 88.13 Favored Glycine 0 CA--C 1.535 1.343 0 C-N-CA 125.059 1.314 . . . . 0.0 115.059 -176.519 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 59.1 m95 -95.08 154.1 17.34 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 126.025 1.73 . . . . 0.0 112.643 174.008 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 13.1 mt -131.04 159.73 36.68 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 123.18 0.592 . . . . 0.0 111.161 168.967 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 48.3 ttm -117.27 139.55 50.67 Favored 'General case' 0 CA--C 1.527 0.091 0 C-N-CA 125.384 1.474 . . . . 0.0 110.712 -179.668 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -170.37 -175.75 39.39 Favored Glycine 0 CA--C 1.523 0.584 0 C-N-CA 123.943 0.783 . . . . 0.0 112.49 -178.896 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 14.9 p -128.04 138.82 53.61 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.444 0 C-N-CA 125.406 1.482 . . . . 0.0 108.578 169.526 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 38.7 mtmt -58.09 134.43 56.43 Favored 'General case' 0 N--CA 1.465 0.307 0 O-C-N 121.377 -0.827 . . . . 0.0 110.559 176.198 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -58.92 -42.99 91.0 Favored 'General case' 0 C--O 1.22 -0.469 0 CA-C-O 118.773 -0.632 . . . . 0.0 109.749 175.552 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 57.4 p -60.0 -22.59 62.77 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 115.508 1.67 . . . . 0.0 115.508 174.074 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 53.9 m-20 -85.13 -45.31 12.19 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.962 1.305 . . . . 0.0 114.219 173.862 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 59.4 t-105 -67.57 -35.86 79.84 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.323 1.449 . . . . 0.0 112.826 174.857 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 9.7 t-20 -77.7 -14.44 59.61 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 126.21 1.804 . . . . 0.0 112.852 175.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 57.4 mm-40 -90.81 0.46 57.45 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 125.198 1.399 . . . . 0.0 112.666 162.106 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 93.6 m-70 59.58 34.85 22.46 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 127.871 2.468 . . . . 0.0 114.044 175.894 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 6.6 mtpm? -74.45 147.78 41.68 Favored 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 125.217 1.407 . . . . 0.0 110.659 177.806 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 6.7 pm0 -51.94 103.58 0.07 Allowed 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 126.585 1.954 . . . . 0.0 114.505 -175.397 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 57.5 tp -51.38 -49.63 61.14 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 126.236 1.814 . . . . 0.0 113.27 -171.713 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 92.6 mt-10 -66.02 -13.43 59.91 Favored 'General case' 0 CA--C 1.546 0.805 0 N-CA-C 114.154 1.168 . . . . 0.0 114.154 -175.757 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 33.5 mmtp -106.7 -30.13 9.16 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 125.381 1.472 . . . . 0.0 112.963 171.818 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 84.0 m -82.9 -23.04 33.75 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 114.221 1.193 . . . . 0.0 114.221 -176.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 40.3 ptt180 -63.64 162.61 12.77 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.907 1.283 . . . . 0.0 112.753 173.287 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -175.43 176.21 47.31 Favored Glycine 0 CA--C 1.529 0.929 0 CA-C-N 115.282 -0.872 . . . . 0.0 115.132 170.525 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 34.1 m -93.36 140.88 15.61 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 C-N-CA 124.819 1.247 . . . . 0.0 112.242 169.482 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 50.8 p90 -140.37 155.92 69.88 Favored Pre-proline 0 CA--C 1.544 0.721 0 C-N-CA 125.259 1.423 . . . . 0.0 112.484 176.738 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_endo -71.11 112.37 3.29 Favored 'Trans proline' 0 CA--C 1.533 0.467 0 C-N-CA 122.535 2.157 . . . . 0.0 109.667 171.158 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 20.2 pt-20 -57.56 -26.06 60.88 Favored 'General case' 0 N--CA 1.476 0.871 0 O-C-N 121.286 -0.884 . . . . 0.0 112.441 179.906 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 10.1 p-10 -71.75 -10.72 60.19 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 125.683 1.593 . . . . 0.0 114.859 177.268 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 18.6 m-85 -75.65 -13.83 60.34 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 117.003 2.223 . . . . 0.0 117.003 160.051 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 589' ' ' THR . . . . . 0.492 HG22 ' HA ' ' A' ' 527' ' ' ALA . 73.4 p -122.13 175.8 6.17 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 126.339 1.856 . . . . 0.0 110.477 -175.91 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -124.59 137.78 54.37 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 124.145 0.978 . . . . 0.0 108.803 170.003 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.67 125.56 27.78 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 123.742 0.817 . . . . 0.0 109.151 179.666 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 592' ' ' VAL . . . . . . . . . . . . . 7.1 m -112.22 156.61 41.76 Favored Pre-proline 0 N--CA 1.479 1.022 0 C-N-CA 124.911 1.284 . . . . 0.0 109.774 -175.586 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 593' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo . . . . . 0 C--O 1.252 1.214 0 C-N-CA 124.508 3.472 . . . . 0.0 113.437 -175.196 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B 1728 ' ' SER . . . . . . . . . . . . . 41.6 p . . . . . 0 N--CA 1.475 0.806 0 CA-C-O 120.786 0.327 . . . . 0.0 111.0 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B 1729 ' ' THR . . . . . . . . . . . . . 15.0 t -105.25 -17.75 14.36 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 125.847 1.659 . . . . 0.0 114.446 -175.73 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B 1730 ' ' VAL . . . . . . . . . . . . . 22.1 m -68.78 150.15 97.71 Favored Pre-proline 0 N--CA 1.476 0.838 0 O-C-N 121.512 -0.742 . . . . 0.0 112.247 174.221 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -69.16 166.32 27.27 Favored 'Trans proline' 0 CA--C 1.54 0.8 0 C-N-CA 123.44 2.76 . . . . 0.0 112.784 171.263 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 4.1 t -135.44 135.14 51.97 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 C-N-CA 124.978 1.311 . . . . 0.0 112.83 178.631 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -61.62 136.63 94.69 Favored Pre-proline 0 CA--C 1.554 1.127 0 O-C-N 121.636 -0.665 . . . . 0.0 112.253 178.321 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -71.52 168.08 24.58 Favored 'Trans proline' 0 CA--C 1.543 0.972 0 C-N-CA 123.305 2.67 . . . . 0.0 111.586 171.712 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -63.94 165.48 18.81 Favored 'Trans proline' 0 CA--C 1.542 0.889 0 C-N-CA 122.739 2.293 . . . . 0.0 113.211 -179.564 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B 1736 ' ' ARG . . . . . . . . . . . . . 10.7 mtm180 -142.83 171.68 13.72 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 127.696 2.398 . . . . 0.0 107.168 178.635 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B 1737 ' ' ARG . . . . . . . . . . . . . 22.4 ptt-85 -146.77 159.47 43.46 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 113.461 0.912 . . . . 0.0 113.461 -174.477 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B 1738 ' ' ARG . . . . . . . . . . . . . 6.0 tpp180 -74.97 131.04 40.37 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 125.573 1.549 . . . . 0.0 111.723 -176.009 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B 1739 ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -80.62 151.5 28.99 Favored 'General case' 0 N--CA 1.477 0.92 0 N-CA-C 114.255 1.205 . . . . 0.0 114.255 -178.366 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B 1740 ' ' GLY . . . . . . . . . . . . . . . -57.14 -30.09 60.45 Favored Glycine 0 CA--C 1.536 1.368 0 C-N-CA 125.834 1.683 . . . . 0.0 117.104 -166.405 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B 1741 ' ' ARG . . . . . . . . . . . . . 3.2 mmp_? -57.21 -4.88 0.23 Allowed 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 125.828 1.651 . . . . 0.0 115.146 171.37 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B 1742 ' ' ASN . . . . . . . . . . . . . 20.5 t-20 -59.29 -11.19 3.74 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 126.727 2.011 . . . . 0.0 115.72 163.592 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B 1743 ' ' LEU . . . . . . . . . . . . . 1.3 pt? -64.7 165.13 10.85 Favored 'General case' 0 CA--C 1.549 0.927 0 CA-C-N 119.667 1.121 . . . . 0.0 113.787 174.051 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B 1744 ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.252 1.205 0 N-CA-C 118.911 2.93 . . . . 0.0 118.911 -173.889 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 513' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.925 0 N-CA-C 110.386 -1.086 . . . . 0.0 110.386 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 514' ' ' ARG . . . . . . . . . . . . . 3.3 ppt_? -88.15 166.06 14.66 Favored 'General case' 0 N--CA 1.476 0.859 0 N-CA-C 114.264 1.209 . . . . 0.0 114.264 -172.754 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -93.77 -57.99 2.39 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.343 1.057 . . . . 0.0 109.618 165.886 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 516' ' ' ASP . . . . . . . . . . . . . 17.9 p30 -124.47 166.09 16.63 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 117.509 2.411 . . . . 0.0 117.509 -169.519 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 517' ' ' LEU . . . . . 0.418 HD22 HD22 ' A' ' 548' ' ' LEU . 10.5 mt -81.07 161.72 61.96 Favored Pre-proline 0 CA--C 1.551 0.99 0 C-N-CA 125.55 1.54 . . . . 0.0 111.945 160.028 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -69.27 161.35 46.24 Favored 'Trans proline' 0 CA--C 1.537 0.648 0 C-N-CA 124.02 3.146 . . . . 0.0 113.782 -175.643 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 65.8 Cg_endo -61.87 142.06 92.04 Favored 'Trans proline' 0 N--CA 1.458 -0.569 0 C-N-CA 122.732 2.288 . . . . 0.0 110.283 178.139 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 67.37 3.56 26.03 Favored Glycine 0 CA--C 1.533 1.186 0 CA-C-O 117.198 -1.89 . . . . 0.0 116.177 -178.369 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 27.9 t80 -40.56 137.28 1.15 Allowed 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 116.886 2.18 . . . . 0.0 116.886 -178.119 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 57.1 mtm -112.91 -53.87 2.67 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 113.435 0.902 . . . . 0.0 113.435 -174.748 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 523' ' ' PHE . . . . . 0.481 ' CE1' HG21 ' A' ' 549' ' ' VAL . 26.1 p90 -167.36 174.32 8.12 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 126.612 1.965 . . . . 0.0 111.389 -178.205 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 524' ' ' LYS . . . . . 0.483 ' HE2' ' CD2' ' A' ' 548' ' ' LEU . 78.1 mttt -109.41 161.95 14.82 Favored 'General case' 0 N--CA 1.467 0.414 0 O-C-N 121.413 -0.804 . . . . 0.0 111.226 171.759 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 5.6 m -130.23 163.83 34.74 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 C-N-CA 126.261 1.824 . . . . 0.0 110.202 165.411 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 60.8 tt0 -129.52 130.81 46.26 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 118.836 0.744 . . . . 0.0 112.694 169.586 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 527' ' ' ALA . . . . . 0.529 ' HA ' HG22 ' A' ' 589' ' ' THR . . . -64.07 119.14 9.58 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.604 1.162 . . . . 0.0 112.335 -178.06 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 46.9 mm-40 -86.13 -22.23 27.18 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.229 1.411 . . . . 0.0 111.417 171.762 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 89.1 m-70 -140.87 157.69 45.02 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 126.404 1.882 . . . . 0.0 110.455 178.033 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -84.77 141.79 30.27 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 -178.656 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 76.9 t80 -136.45 120.7 17.91 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 125.895 1.678 . . . . 0.0 112.306 -179.532 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 1.9 m -90.37 132.78 35.4 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 114.01 1.115 . . . . 0.0 114.01 175.233 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -67.36 128.45 36.44 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-O 121.588 0.709 . . . . 0.0 112.186 -176.655 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 1.7 p -107.19 -3.64 19.62 Favored 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 116.743 2.127 . . . . 0.0 116.743 -177.647 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 34.9 t0 -143.87 165.78 26.77 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 124.799 1.24 . . . . 0.0 108.984 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 1.5 t -55.83 -35.51 66.46 Favored 'General case' 0 N--CA 1.464 0.271 0 N-CA-C 114.673 1.36 . . . . 0.0 114.673 167.081 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 90.2 m-20 -68.06 -22.71 64.93 Favored 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 117.093 2.257 . . . . 0.0 117.093 176.25 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -88.2 144.8 26.24 Favored 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 115.398 1.629 . . . . 0.0 115.398 -163.137 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -90.28 139.89 30.22 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 127.326 2.25 . . . . 0.0 109.82 177.552 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 15.9 tt0 -91.63 131.13 37.25 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.801 0.84 . . . . 0.0 110.559 171.393 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 80.5 mt -124.89 136.94 54.25 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 124.998 1.319 . . . . 0.0 111.961 -179.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 3.3 tppp? -96.27 141.72 29.27 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 125.873 1.669 . . . . 0.0 110.495 163.614 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -57.25 107.73 0.45 Allowed 'General case' 0 CA--C 1.545 0.752 0 CA-C-N 119.281 0.946 . . . . 0.0 109.907 170.163 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 122.46 -11.06 9.11 Favored Glycine 0 CA--C 1.537 1.437 0 C-N-CA 126.546 2.022 . . . . 0.0 114.592 -172.191 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 74.6 m-20 -71.85 124.86 25.75 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 119.835 1.818 . . . . 0.0 115.72 -178.029 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 16.7 t -74.89 133.25 31.88 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 C-N-CA 123.232 0.613 . . . . 0.0 110.369 164.382 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -125.48 122.15 61.92 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.443 0 C-N-CA 125.011 1.324 . . . . 0.0 111.136 175.84 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 548' ' ' LEU . . . . . 0.483 ' CD2' ' HE2' ' A' ' 524' ' ' LYS . 20.8 mt -79.93 103.45 9.82 Favored 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 108.149 -1.056 . . . . 0.0 108.149 177.643 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 549' ' ' VAL . . . . . 0.481 HG21 ' CE1' ' A' ' 523' ' ' PHE . 4.0 t -62.32 126.32 20.33 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.083 0 N-CA-C 113.499 0.926 . . . . 0.0 113.499 172.204 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 20.5 pt -126.43 159.8 61.23 Favored Pre-proline 0 N--CA 1.474 0.744 0 C-N-CA 126.978 2.111 . . . . 0.0 108.94 179.219 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo -72.54 149.74 50.14 Favored 'Trans proline' 0 N--CA 1.456 -0.711 0 C-N-CA 122.948 2.432 . . . . 0.0 112.303 175.362 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 72.0 m-85 -64.28 147.53 52.26 Favored 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 113.526 0.936 . . . . 0.0 113.526 167.775 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 553' ' ' GLN . . . . . . . . . . . . . 11.7 pm0 -67.17 -19.89 65.65 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.386 1.475 . . . . 0.0 114.069 170.017 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 7.0 m-20 -151.78 147.13 19.51 Favored Pre-proline 0 CA--C 1.543 0.688 0 C-N-CA 125.447 1.499 . . . . 0.0 112.506 179.883 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 555' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -68.46 -31.53 27.32 Favored 'Trans proline' 0 CA--C 1.535 0.568 0 C-N-CA 124.096 3.197 . . . . 0.0 112.329 175.439 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -77.73 -11.7 59.9 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.756 1.623 . . . . 0.0 114.065 177.467 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 557' ' ' GLU . . . . . . . . . . . . . 23.9 mm-40 -75.0 -33.09 61.78 Favored 'General case' 0 N--CA 1.476 0.868 0 O-C-N 120.986 -1.071 . . . . 0.0 112.721 165.884 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 54.6 tt0 -66.36 128.26 35.48 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 124.373 1.069 . . . . 0.0 112.62 -168.466 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 72.5 m-20 -103.99 145.72 29.74 Favored 'General case' 0 CA--C 1.554 1.135 0 C-N-CA 125.684 1.594 . . . . 0.0 113.066 -176.937 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 72.5 tt0 -76.87 107.53 9.26 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 124.786 1.234 . . . . 0.0 112.938 -169.406 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 96.11 1.29 61.27 Favored Glycine 0 CA--C 1.537 1.419 0 C-N-CA 125.072 1.32 . . . . 0.0 114.392 -174.745 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 53.5 m95 -93.53 169.48 10.31 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 126.344 1.857 . . . . 0.0 113.31 176.67 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 16.6 mt -141.38 153.22 44.95 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 125.488 1.515 . . . . 0.0 110.39 165.787 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 57.5 ttm -105.25 142.52 34.87 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 125.396 1.479 . . . . 0.0 112.262 170.575 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -165.24 -174.83 35.31 Favored Glycine 0 CA--C 1.527 0.788 0 C-N-CA 124.946 1.26 . . . . 0.0 112.795 174.566 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 12.7 p -128.92 139.99 50.43 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 C-N-CA 125.127 1.371 . . . . 0.0 109.321 169.777 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 34.9 mtmt -58.02 135.59 56.99 Favored 'General case' 0 N--CA 1.468 0.435 0 O-C-N 121.538 -0.726 . . . . 0.0 110.814 175.407 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -59.22 -38.88 81.05 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-O 118.159 -0.924 . . . . 0.0 111.215 176.768 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 8.7 t -71.77 -32.65 67.9 Favored 'General case' 0 N--CA 1.477 0.89 0 CA-C-N 119.912 1.233 . . . . 0.0 111.782 -179.175 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 71.2 m-20 -61.59 -50.19 73.62 Favored 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 113.669 0.989 . . . . 0.0 113.669 167.751 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 49.8 t-105 -68.04 -33.36 74.42 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 114.305 1.224 . . . . 0.0 114.305 -179.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 8.4 t-20 -68.17 -30.16 69.2 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.591 1.157 . . . . 0.0 111.919 178.292 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 41.6 mt-30 -78.3 3.47 15.42 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.489 1.116 . . . . 0.0 112.984 170.764 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 26.0 m-70 61.15 31.46 19.63 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 126.538 1.935 . . . . 0.0 112.897 179.573 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 20.9 mttm -65.11 154.7 37.15 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 123.883 0.873 . . . . 0.0 112.807 179.819 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 9.1 pm0 -53.18 104.74 0.1 Allowed 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 126.152 1.781 . . . . 0.0 112.892 179.573 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 58.2 tp -64.02 -50.08 69.85 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 124.488 1.115 . . . . 0.0 111.917 -166.299 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 16.1 pm0 -61.39 -22.8 65.31 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.285 1.034 . . . . 0.0 113.778 -178.149 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 23.4 tptm -88.46 -55.27 3.79 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 126.062 1.745 . . . . 0.0 111.195 175.124 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 87.8 m -75.0 -19.63 60.0 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 125.155 1.382 . . . . 0.0 114.694 -168.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 19.9 ptt180 -64.03 160.47 17.94 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 123.649 0.78 . . . . 0.0 111.61 170.202 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -166.21 172.33 41.5 Favored Glycine 0 CA--C 1.525 0.709 0 CA-C-N 115.142 -0.936 . . . . 0.0 113.158 173.302 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 22.7 m -91.61 145.53 7.39 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.34 0 C-N-CA 124.427 1.091 . . . . 0.0 111.245 168.853 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 47.4 p90 -140.57 155.5 69.63 Favored Pre-proline 0 C--O 1.24 0.6 0 C-N-CA 124.82 1.248 . . . . 0.0 112.664 176.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -67.95 109.41 1.92 Allowed 'Trans proline' 0 N--CA 1.457 -0.623 0 C-N-CA 122.0 1.8 . . . . 0.0 109.62 170.503 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 19.2 pt-20 -54.47 -28.02 41.68 Favored 'General case' 0 N--CA 1.476 0.844 0 O-C-N 121.215 -0.928 . . . . 0.0 112.386 -179.627 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 11.6 p-10 -69.07 -13.59 62.53 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 126.143 1.777 . . . . 0.0 114.361 177.554 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 15.0 m-85 -74.39 -12.83 60.62 Favored 'General case' 0 N--CA 1.467 0.382 0 N-CA-C 116.802 2.149 . . . . 0.0 116.802 163.561 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 589' ' ' THR . . . . . 0.529 HG22 ' HA ' ' A' ' 527' ' ' ALA . 73.4 p -123.99 173.99 7.88 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 125.404 1.482 . . . . 0.0 111.679 -172.93 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -119.89 140.99 50.0 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.746 1.218 . . . . 0.0 108.942 169.726 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 15.0 tpt180 -67.44 105.72 1.9 Allowed 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.496 1.119 . . . . 0.0 108.959 171.545 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 592' ' ' VAL . . . . . 0.445 HG23 ' HB2' ' A' ' 524' ' ' LYS . 2.1 m -83.83 156.65 64.36 Favored Pre-proline 0 CA--C 1.541 0.633 0 C-N-CA 123.637 0.775 . . . . 0.0 109.275 178.963 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 593' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_exo . . . . . 0 C--O 1.255 1.368 1 C-N-CA 126.398 4.732 . . . . 0.0 115.654 172.355 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B 1728 ' ' SER . . . . . . . . . . . . . 3.3 m . . . . . 0 N--CA 1.477 0.886 0 N-CA-C 113.046 0.758 . . . . 0.0 113.046 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B 1729 ' ' THR . . . . . . . . . . . . 0.257 0.2 OUTLIER -118.21 -20.86 8.43 Favored 'General case' 0 N--CA 1.481 1.08 0 N-CA-C 117.166 2.284 . . . . 0.0 117.166 -170.445 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B 1730 ' ' VAL . . . . . . . . . . . . . 12.6 m -69.76 150.27 96.62 Favored Pre-proline 0 N--CA 1.476 0.837 0 C-N-CA 125.119 1.368 . . . . 0.0 112.824 175.556 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -67.46 165.04 28.51 Favored 'Trans proline' 0 CA--C 1.542 0.912 0 C-N-CA 123.947 3.098 . . . . 0.0 114.039 179.896 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 29.7 t -133.85 131.51 56.35 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 125.63 1.572 . . . . 0.0 111.429 -179.622 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -65.62 139.47 97.11 Favored Pre-proline 0 CA--C 1.552 1.039 0 O-C-N 121.439 -0.788 . . . . 0.0 112.361 -179.047 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo -75.13 164.94 32.15 Favored 'Trans proline' 0 CA--C 1.547 1.152 0 C-N-CA 123.186 2.59 . . . . 0.0 112.62 175.709 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -58.55 159.86 18.85 Favored 'Trans proline' 0 CA--C 1.541 0.86 0 C-N-CA 123.67 2.913 . . . . 0.0 114.223 174.888 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B 1736 ' ' ARG . . . . . . . . . . . . . 51.3 mtp180 -127.35 164.24 22.25 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 126.04 1.736 . . . . 0.0 111.715 173.605 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B 1737 ' ' ARG . . . . . . . . . . . . . 35.7 ptt180 -143.47 158.71 43.43 Favored 'General case' 0 N--CA 1.48 1.042 0 N-CA-C 114.529 1.307 . . . . 0.0 114.529 -159.371 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B 1738 ' ' ARG . . . . . . . . . . . . . 26.0 mtp-105 -52.9 148.96 6.88 Favored 'General case' 0 N--CA 1.476 0.836 0 N-CA-C 115.09 1.515 . . . . 0.0 115.09 -179.668 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B 1739 ' ' ARG . . . . . . . . . . . . . 18.4 ttp85 -93.01 151.23 20.02 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 125.654 1.582 . . . . 0.0 109.004 155.604 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B 1740 ' ' GLY . . . . . . . . . . . . . . . 83.89 173.83 49.99 Favored Glycine 0 CA--C 1.536 1.361 0 N-CA-C 110.645 -0.982 . . . . 0.0 110.645 -152.012 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B 1741 ' ' ARG . . . . . . . . . . . . . 47.5 ptt85 -69.92 134.62 48.61 Favored 'General case' 0 N--CA 1.48 1.052 0 CA-C-N 118.789 1.295 . . . . 0.0 113.435 -170.788 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B 1742 ' ' ASN . . . . . . . . . . . . . 15.5 m120 -88.32 62.73 6.81 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 126.123 1.769 . . . . 0.0 109.829 -176.174 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B 1743 ' ' LEU . . . . . . . . . . . . . 1.8 pt? -66.94 133.96 51.04 Favored 'General case' 0 CA--C 1.537 0.479 0 N-CA-C 114.016 1.117 . . . . 0.0 114.016 -166.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B 1744 ' ' THR . . . . . . . . . . . . . 7.8 t . . . . . 0 C--O 1.257 1.46 0 C-N-CA 126.857 2.063 . . . . 0.0 111.692 174.904 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 513' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 1.017 0 N-CA-C 110.519 -1.033 . . . . 0.0 110.519 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 514' ' ' ARG . . . . . . . . . . . . . 16.2 ptt85 -79.66 145.52 32.97 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 113.116 0.784 . . . . 0.0 113.116 -174.802 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 51.2 tp -78.61 -34.97 46.27 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.442 1.497 . . . . 0.0 113.765 -178.346 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 516' ' ' ASP . . . . . . . . . . . . . 31.8 t0 -64.61 148.36 51.04 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 123.809 0.843 . . . . 0.0 111.973 -172.288 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 517' ' ' LEU . . . . . 0.517 HD22 HD22 ' A' ' 548' ' ' LEU . 14.1 mt -131.65 159.83 70.15 Favored Pre-proline 0 CA--C 1.545 0.77 0 C-N-CA 126.691 1.996 . . . . 0.0 111.818 -169.406 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -68.45 159.26 54.18 Favored 'Trans proline' 0 CA--C 1.539 0.771 0 C-N-CA 123.957 3.105 . . . . 0.0 113.38 -172.734 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -61.89 128.42 24.24 Favored 'Trans proline' 0 N--CA 1.459 -0.536 0 C-N-CA 123.218 2.612 . . . . 0.0 111.321 -174.759 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 73.48 5.47 67.85 Favored Glycine 0 CA--C 1.537 1.446 0 CA-C-O 116.865 -2.075 . . . . 0.0 115.805 -177.177 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 22.2 t80 -35.67 133.96 0.37 Allowed 'General case' 0 N--CA 1.471 0.608 0 CA-C-N 120.508 2.154 . . . . 0.0 116.52 177.254 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 53.3 mtm -107.08 -57.45 2.07 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 123.541 0.736 . . . . 0.0 111.701 -177.301 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 523' ' ' PHE . . . . . . . . . . . . . 25.8 p90 -160.25 169.66 22.75 Favored 'General case' 0 C--O 1.222 -0.366 0 C-N-CA 125.168 1.387 . . . . 0.0 114.142 -174.571 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 524' ' ' LYS . . . . . 0.547 ' HG2' HD23 ' A' ' 548' ' ' LEU . 85.3 mttt -102.6 164.19 11.79 Favored 'General case' 0 CA--C 1.538 0.485 0 O-C-N 121.118 -0.989 . . . . 0.0 112.272 168.056 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 10.2 m -136.32 159.49 38.34 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 C-N-CA 127.051 2.14 . . . . 0.0 109.546 165.109 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 45.0 tt0 -123.58 128.57 49.89 Favored 'General case' 0 N--CA 1.475 0.779 0 CA-C-N 119.323 0.965 . . . . 0.0 112.213 168.755 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 527' ' ' ALA . . . . . 0.493 ' HA ' HG22 ' A' ' 589' ' ' THR . . . -64.03 122.61 16.95 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.103 0.961 . . . . 0.0 112.313 -179.275 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 48.5 mm-40 -88.23 -23.18 23.61 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.497 1.519 . . . . 0.0 111.867 174.514 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 93.8 m-70 -139.65 157.74 45.27 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 126.984 2.114 . . . . 0.0 110.206 -175.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 34.8 p-10 -87.19 135.65 33.22 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 119.374 0.988 . . . . 0.0 113.22 -179.503 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 83.0 t80 -128.63 110.03 11.87 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 124.6 1.16 . . . . 0.0 111.829 -178.332 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 532' ' ' THR . . . . . . . . . . . . 0.253 0.2 OUTLIER -82.91 113.91 20.84 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 114.148 1.166 . . . . 0.0 114.148 168.677 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -62.02 143.73 56.16 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 123.858 0.863 . . . . 0.0 112.186 175.43 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 534' ' ' THR . . . . . . . . . . . . 0.27 4.6 t -126.23 21.96 7.27 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 127.233 2.213 . . . . 0.0 114.36 179.496 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 38.7 t0 -152.63 156.24 38.88 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 107.565 -1.272 . . . . 0.0 107.565 165.764 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 5.0 t -68.17 -10.39 53.92 Favored 'General case' 0 N--CA 1.476 0.86 0 N-CA-C 114.956 1.465 . . . . 0.0 114.956 167.33 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 39.7 t0 -77.55 -31.03 53.02 Favored 'General case' 0 CA--C 1.553 1.07 0 C-N-CA 125.506 1.523 . . . . 0.0 110.989 167.037 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 82.8 mt-10 -81.52 147.16 29.81 Favored 'General case' 0 CA--C 1.547 0.835 0 O-C-N 120.265 -1.522 . . . . 0.0 113.67 -175.779 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -93.14 139.04 31.01 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 127.068 2.147 . . . . 0.0 110.31 176.027 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 15.6 tt0 -94.72 129.91 41.44 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.408 1.083 . . . . 0.0 111.574 179.423 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 76.7 mt -128.56 148.7 50.78 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.699 1.2 . . . . 0.0 112.86 -176.023 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 12.5 tmtt? -120.41 148.13 44.17 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 126.32 1.848 . . . . 0.0 109.841 169.766 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -56.29 99.5 0.03 OUTLIER 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 123.735 0.814 . . . . 0.0 111.856 174.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 127.73 -4.59 7.03 Favored Glycine 0 CA--C 1.537 1.456 0 C-N-CA 126.659 2.076 . . . . 0.0 114.304 -176.282 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 81.6 m-20 -79.33 120.88 24.4 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 119.395 1.597 . . . . 0.0 113.648 -176.018 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 36.6 t -74.49 135.01 28.33 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 CA-C-N 119.138 0.881 . . . . 0.0 110.15 168.695 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -123.1 122.21 64.96 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.508 0 C-N-CA 125.651 1.58 . . . . 0.0 111.496 174.549 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 548' ' ' LEU . . . . . 0.547 HD23 ' HG2' ' A' ' 524' ' ' LYS . 42.4 mt -78.44 101.2 7.18 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.457 1.103 . . . . 0.0 108.318 175.279 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 549' ' ' VAL . . . . . . . . . . . . . 4.4 t -63.97 131.49 29.62 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.337 0 N-CA-C 114.844 1.424 . . . . 0.0 114.844 173.313 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 15.8 pt -131.93 154.76 81.84 Favored Pre-proline 0 CA--C 1.548 0.903 0 C-N-CA 126.383 1.873 . . . . 0.0 111.28 -178.78 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -72.81 149.18 47.56 Favored 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 124.321 3.347 . . . . 0.0 111.785 173.597 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 63.6 m-85 -71.15 142.09 50.72 Favored 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 114.897 1.443 . . . . 0.0 114.897 -178.656 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 553' ' ' GLN . . . . . 0.506 ' CD ' ' H ' ' A' ' 553' ' ' GLN . 0.0 OUTLIER -71.05 -19.09 62.53 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 127.797 2.439 . . . . 0.0 114.302 169.072 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 17.7 m-20 -142.78 157.95 60.55 Favored Pre-proline 0 CA--C 1.542 0.667 0 C-N-CA 125.869 1.668 . . . . 0.0 112.658 -172.454 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 555' ' ' PRO . . . . . . . . . . . . . 95.0 Cg_endo -73.0 -43.4 0.76 Allowed 'Trans proline' 0 CA--C 1.54 0.822 0 C-N-CA 122.934 2.423 . . . . 0.0 110.998 159.834 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -71.65 -12.73 61.48 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 114.925 1.454 . . . . 0.0 114.925 -170.915 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 557' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -90.82 -19.4 23.47 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.263 1.425 . . . . 0.0 113.041 176.265 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 39.9 tt0 -87.1 114.32 23.61 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.8 1.24 . . . . 0.0 114.152 -176.435 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 54.5 m-20 -93.36 150.25 20.61 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 126.183 1.793 . . . . 0.0 111.726 174.677 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 30.7 tp10 -80.8 127.99 33.15 Favored 'General case' 0 N--CA 1.474 0.726 0 O-C-N 120.968 -1.083 . . . . 0.0 110.895 -177.334 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 83.88 4.9 88.4 Favored Glycine 0 CA--C 1.538 1.501 0 O-C-N 121.327 -0.858 . . . . 0.0 114.705 -173.153 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 562' ' ' TRP . . . . . 0.483 ' CZ2' ' HD3' ' B' 1736 ' ' ARG . 50.2 m95 -110.74 157.38 19.83 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 127.019 2.128 . . . . 0.0 112.598 178.401 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 11.5 mt -133.15 153.74 51.25 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 123.286 0.634 . . . . 0.0 110.992 173.564 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 41.9 ttm -106.37 142.76 35.51 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 123.997 0.919 . . . . 0.0 112.136 177.123 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -165.25 -170.34 30.07 Favored Glycine 0 CA--C 1.525 0.697 0 C-N-CA 124.282 0.944 . . . . 0.0 112.309 173.69 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 14.3 p -134.41 140.7 45.34 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.502 0 C-N-CA 125.966 1.707 . . . . 0.0 108.993 170.884 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 41.7 mtmt -62.42 134.76 56.89 Favored 'General case' 0 N--CA 1.465 0.304 0 O-C-N 121.139 -0.976 . . . . 0.0 112.064 176.636 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -57.36 -43.06 83.2 Favored 'General case' 0 C--O 1.222 -0.375 0 CA-C-O 118.12 -0.943 . . . . 0.0 111.391 -177.006 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 33.2 t -62.62 -33.1 74.32 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 119.358 0.981 . . . . 0.0 113.529 -178.849 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -69.69 -45.95 67.12 Favored 'General case' 0 CA--C 1.542 0.672 0 O-C-N 120.835 -1.166 . . . . 0.0 108.812 176.19 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 66.1 t-105 -66.72 -36.3 82.16 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 124.329 1.052 . . . . 0.0 112.525 179.49 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -67.78 -31.27 71.04 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 126.288 1.835 . . . . 0.0 111.783 175.213 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 44.1 mt-30 -77.09 -0.63 25.48 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.609 1.164 . . . . 0.0 113.73 172.287 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 67.0 m-70 68.37 18.85 9.05 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 127.99 2.516 . . . . 0.0 115.119 -178.406 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 6.7 mtpm? -76.34 160.71 29.35 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 125.233 1.413 . . . . 0.0 112.987 -173.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 18.1 pm0 -58.72 127.29 31.43 Favored 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 114.189 1.181 . . . . 0.0 114.189 -175.059 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 62.0 tp -75.31 -45.81 37.3 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 125.405 1.482 . . . . 0.0 111.891 -173.622 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 23.9 pt-20 -62.81 -18.33 62.61 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 113.856 1.058 . . . . 0.0 113.856 -174.506 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 4.2 tppp? -95.07 -41.57 9.05 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 126.065 1.746 . . . . 0.0 113.715 176.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 48.3 t -78.25 -28.18 47.7 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 118.568 0.622 . . . . 0.0 112.479 -179.796 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 50.7 ptt85 -54.08 149.47 9.35 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-O 121.74 0.781 . . . . 0.0 112.382 -179.74 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -172.47 170.73 43.77 Favored Glycine 0 N--CA 1.462 0.427 0 CA-C-N 115.358 -0.837 . . . . 0.0 114.348 177.025 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 17.6 m -91.91 136.78 23.59 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.252 0 C-N-CA 124.782 1.233 . . . . 0.0 111.43 171.854 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 44.6 p90 -132.57 154.79 81.65 Favored Pre-proline 0 CA--C 1.539 0.536 0 C-N-CA 124.358 1.063 . . . . 0.0 112.968 175.711 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -68.46 110.78 2.36 Favored 'Trans proline' 0 N--CA 1.457 -0.655 0 C-N-CA 122.262 1.975 . . . . 0.0 110.02 169.702 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 21.3 pt-20 -55.79 -29.49 59.77 Favored 'General case' 0 CA--C 1.547 0.855 0 O-C-N 121.416 -0.802 . . . . 0.0 112.233 -179.832 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 9.7 p-10 -67.22 -8.7 33.55 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 126.141 1.776 . . . . 0.0 114.523 179.446 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 17.1 m-85 -82.68 -11.9 58.0 Favored 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 116.783 2.142 . . . . 0.0 116.783 166.622 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 589' ' ' THR . . . . . 0.493 HG22 ' HA ' ' A' ' 527' ' ' ALA . 60.4 p -122.77 173.23 7.88 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 125.511 1.525 . . . . 0.0 111.528 -171.881 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -124.14 139.45 53.91 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.061 0.945 . . . . 0.0 108.997 170.13 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.82 136.23 57.25 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 125.149 1.379 . . . . 0.0 109.127 177.225 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 592' ' ' VAL . . . . . 0.524 HG23 ' HB2' ' A' ' 524' ' ' LYS . 2.4 m -126.87 155.57 75.27 Favored Pre-proline 0 N--CA 1.481 1.115 0 C-N-CA 124.78 1.232 . . . . 0.0 109.486 177.783 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 593' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo . . . . . 0 C--O 1.253 1.242 0 C-N-CA 124.325 3.35 . . . . 0.0 114.527 -170.825 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B 1728 ' ' SER . . . . . . . . . . . . . 89.4 p . . . . . 0 N--CA 1.472 0.658 0 CA-C-O 121.253 0.549 . . . . 0.0 110.803 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B 1729 ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -82.38 7.98 12.65 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 127.546 2.339 . . . . 0.0 117.118 -168.837 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B 1730 ' ' VAL . . . . . . . . . . . . . 16.6 m -62.67 151.56 83.87 Favored Pre-proline 0 CA--C 1.547 0.848 0 C-N-CA 126.075 1.75 . . . . 0.0 113.302 179.329 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -69.17 169.68 17.6 Favored 'Trans proline' 0 CA--C 1.542 0.879 0 C-N-CA 123.758 2.972 . . . . 0.0 112.966 175.757 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 2.9 t -132.49 138.86 51.24 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 C-N-CA 125.777 1.631 . . . . 0.0 112.96 178.869 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B 1733 ' ' ALA . . . . . 0.411 ' HB1' ' CZ2' ' A' ' 562' ' ' TRP . . . -72.63 139.7 80.99 Favored Pre-proline 0 CA--C 1.555 1.135 0 O-C-N 120.763 -1.211 . . . . 0.0 112.759 -176.558 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo -76.23 165.45 29.45 Favored 'Trans proline' 0 CA--C 1.553 1.428 0 C-N-CA 123.049 2.5 . . . . 0.0 114.181 -177.442 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 34.5 Cg_exo -64.66 154.3 73.03 Favored 'Trans proline' 0 C--N 1.351 0.703 0 C-N-CA 123.999 3.133 . . . . 0.0 114.207 179.723 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B 1736 ' ' ARG . . . . . 0.483 ' HD3' ' CZ2' ' A' ' 562' ' ' TRP . 16.1 mtm180 -124.07 167.82 13.7 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 124.98 1.312 . . . . 0.0 112.616 -173.206 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B 1737 ' ' ARG . . . . . . . . . . . . . 65.8 mtt-85 -106.93 156.82 18.3 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 125.904 1.681 . . . . 0.0 114.723 -170.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B 1738 ' ' ARG . . . . . . . . . . . . . 13.0 tpt180 -67.77 116.15 8.12 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 124.632 1.173 . . . . 0.0 111.136 175.679 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B 1739 ' ' ARG . . . . . . . . . . . . . 14.5 ttp85 -80.77 144.68 31.95 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 124.166 0.986 . . . . 0.0 111.066 171.044 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B 1740 ' ' GLY . . . . . . . . . . . . . . . 64.77 -156.14 47.18 Favored Glycine 0 CA--C 1.53 1.029 0 C-N-CA 123.422 0.534 . . . . 0.0 113.43 -168.098 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B 1741 ' ' ARG . . . . . . . . . . . . . 17.6 tpp180 -111.2 138.54 47.52 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.334 1.054 . . . . 0.0 111.16 -178.77 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B 1742 ' ' ASN . . . . . . . . . . . . . 46.3 p-10 -57.88 19.83 0.0 OUTLIER 'General case' 0 CA--C 1.554 1.116 0 C-N-CA 129.091 2.956 . . . . 0.0 117.493 172.11 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B 1743 ' ' LEU . . . . . . . . . . . . . 65.0 tp -55.28 -55.59 29.67 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 125.404 1.482 . . . . 0.0 112.815 -171.476 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B 1744 ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.255 1.395 0 N-CA-C 116.754 2.131 . . . . 0.0 116.754 177.103 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 513' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.215 0 N-CA-C 112.422 -0.271 . . . . 0.0 112.422 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 514' ' ' ARG . . . . . . . . . . . . . 6.7 ppt_? -65.25 169.92 5.2 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 127.477 2.311 . . . . 0.0 115.809 -175.16 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 83.6 mt -84.83 -74.24 0.4 Allowed 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 125.119 1.368 . . . . 0.0 110.668 168.249 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 516' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -117.44 154.69 30.95 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 116.846 2.165 . . . . 0.0 116.846 -175.034 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 517' ' ' LEU . . . . . 0.52 HD22 HD22 ' A' ' 548' ' ' LEU . 14.9 mt -65.36 163.56 31.5 Favored Pre-proline 0 CA--C 1.551 0.992 0 C-N-CA 125.852 1.661 . . . . 0.0 112.605 166.348 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_endo -67.8 162.14 40.86 Favored 'Trans proline' 0 CA--C 1.539 0.775 0 C-N-CA 123.755 2.97 . . . . 0.0 114.055 -176.056 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -64.11 138.67 63.0 Favored 'Trans proline' 0 C--N 1.348 0.546 0 C-N-CA 122.78 2.32 . . . . 0.0 109.89 176.348 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 70.58 4.72 53.69 Favored Glycine 0 CA--C 1.532 1.114 0 CA-C-O 117.638 -1.646 . . . . 0.0 115.69 -176.016 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 48.8 t80 -44.72 129.87 7.03 Favored 'General case' 0 C--O 1.238 0.494 0 CA-C-N 120.82 2.31 . . . . 0.0 115.216 179.697 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 60.1 mtm -105.36 -59.09 1.81 Allowed 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 123.883 0.873 . . . . 0.0 111.932 -179.151 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 523' ' ' PHE . . . . . 0.573 ' CD1' ' HD3' ' A' ' 591' ' ' ARG . 32.5 p90 -160.34 175.45 12.82 Favored 'General case' 0 C--O 1.224 -0.252 0 C-N-CA 126.155 1.782 . . . . 0.0 112.406 -175.555 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 524' ' ' LYS . . . . . 0.517 ' HG2' HD23 ' A' ' 548' ' ' LEU . 81.3 mttt -106.51 164.09 12.34 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 121.023 -1.048 . . . . 0.0 112.65 171.332 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 12.0 m -131.62 160.94 42.02 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 C-N-CA 126.145 1.778 . . . . 0.0 109.552 164.377 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 45.2 tt0 -122.19 128.03 50.72 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 118.613 0.642 . . . . 0.0 111.423 166.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 527' ' ' ALA . . . . . 0.402 ' HA ' HG22 ' A' ' 589' ' ' THR . . . -56.63 123.35 14.55 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.241 1.016 . . . . 0.0 111.209 173.049 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 42.3 mm-40 -84.84 -27.45 26.74 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.153 1.381 . . . . 0.0 110.91 168.596 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 88.0 m-70 -139.34 160.18 40.43 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 127.065 2.146 . . . . 0.0 111.657 -174.23 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . 0.314 1.6 p30 -84.19 138.2 33.11 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 115.713 1.746 . . . . 0.0 115.713 178.932 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 89.3 t80 -138.25 128.33 25.69 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.609 1.564 . . . . 0.0 114.298 -176.147 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -90.8 128.2 36.62 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 124.7 1.2 . . . . 0.0 114.189 175.03 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -69.99 121.78 18.07 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 119.161 0.891 . . . . 0.0 110.822 173.032 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 12.2 t -88.51 -20.55 24.97 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 115.049 1.5 . . . . 0.0 115.049 -177.766 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 18.8 m-20 -145.18 177.5 8.75 Favored 'General case' 0 CA--C 1.554 1.11 0 N-CA-C 116.872 2.175 . . . . 0.0 116.872 -165.856 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 5.3 t -59.37 -17.81 33.28 Favored 'General case' 0 N--CA 1.481 1.09 0 N-CA-C 119.141 3.015 . . . . 0.0 119.141 -173.67 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . 0.287 18.8 m-20 -129.14 16.73 6.14 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 125.9 1.68 . . . . 0.0 115.18 175.776 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 20.0 mp0 -95.67 145.0 25.61 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.947 1.299 . . . . 0.0 112.797 -174.985 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -99.61 128.72 45.72 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 125.194 1.398 . . . . 0.0 111.538 -172.979 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 38.0 tt0 -84.64 124.95 32.04 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 124.843 1.257 . . . . 0.0 110.396 176.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 79.9 mt -125.12 145.99 49.68 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 124.925 1.29 . . . . 0.0 112.275 -178.933 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -115.11 143.73 44.75 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 125.817 1.647 . . . . 0.0 109.367 168.829 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -55.72 110.12 0.67 Allowed 'General case' 0 CA--C 1.545 0.777 0 CA-C-N 118.503 0.592 . . . . 0.0 110.705 179.736 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 115.78 -5.58 20.54 Favored Glycine 0 CA--C 1.538 1.488 0 C-N-CA 126.415 1.96 . . . . 0.0 114.618 -174.796 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 83.2 m-20 -72.82 124.64 25.79 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 115.794 1.775 . . . . 0.0 115.794 -176.906 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 41.7 t -72.84 133.71 31.22 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 C-N-CA 123.68 0.792 . . . . 0.0 110.156 169.116 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 1.5 t -128.07 123.66 60.99 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.328 0 C-N-CA 124.57 1.148 . . . . 0.0 111.527 174.301 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 548' ' ' LEU . . . . . 0.52 HD22 HD22 ' A' ' 517' ' ' LEU . 30.1 mt -79.98 100.47 8.14 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.004 1.322 . . . . 0.0 108.55 177.465 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 549' ' ' VAL . . . . . 0.41 HG21 ' CE1' ' A' ' 523' ' ' PHE . 7.1 t -61.1 132.14 26.46 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.267 0 N-CA-C 114.924 1.453 . . . . 0.0 114.924 173.928 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 20.9 pt -129.99 157.45 76.9 Favored Pre-proline 0 CA--C 1.551 0.981 0 C-N-CA 127.098 2.159 . . . . 0.0 109.873 174.924 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -73.66 154.69 49.56 Favored 'Trans proline' 0 CA--C 1.536 0.601 0 C-N-CA 124.021 3.147 . . . . 0.0 112.094 174.911 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 36.8 m-85 -66.72 149.01 51.14 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 117.195 2.294 . . . . 0.0 117.195 176.395 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 553' ' ' GLN . . . . . . . . . . . . . 6.3 pt20 -70.2 -22.12 62.96 Favored 'General case' 0 N--CA 1.475 0.775 0 N-CA-C 114.243 1.201 . . . . 0.0 114.243 174.562 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 -147.6 146.26 24.0 Favored Pre-proline 0 CA--C 1.54 0.585 0 C-N-CA 125.865 1.666 . . . . 0.0 109.741 170.343 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 555' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -65.57 -35.4 38.3 Favored 'Trans proline' 0 CA--C 1.536 0.604 0 C-N-CA 123.027 2.484 . . . . 0.0 110.831 172.762 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 24.4 pt-20 -72.88 -7.7 52.13 Favored 'General case' 0 CA--C 1.547 0.848 0 N-CA-C 114.492 1.293 . . . . 0.0 114.492 177.237 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 557' ' ' GLU . . . . . . . . . . . . . 21.9 mm-40 -86.58 -23.37 25.8 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 124.787 1.235 . . . . 0.0 113.138 165.892 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -73.76 123.9 25.03 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 123.91 0.884 . . . . 0.0 113.375 -172.252 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . 0.292 18.5 m-20 -96.6 140.03 31.81 Favored 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 116.554 2.057 . . . . 0.0 116.554 -179.175 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 54.9 tp10 -73.88 120.81 19.98 Favored 'General case' 0 CA--C 1.539 0.537 0 O-C-N 120.955 -1.091 . . . . 0.0 112.078 -173.563 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 87.82 3.12 80.63 Favored Glycine 0 CA--C 1.536 1.36 0 C-N-CA 124.514 1.054 . . . . 0.0 114.599 -172.68 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 57.1 m95 -100.98 164.52 11.78 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.569 1.548 . . . . 0.0 112.919 176.284 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 11.6 mt -137.77 152.4 49.13 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 124.943 1.297 . . . . 0.0 109.831 168.699 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 52.1 ttm -108.1 141.97 39.0 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 124.306 1.042 . . . . 0.0 111.503 172.516 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -169.85 -171.79 35.74 Favored Glycine 0 CA--C 1.526 0.767 0 C-N-CA 124.543 1.068 . . . . 0.0 112.666 176.188 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 14.7 p -132.65 138.54 51.79 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 C-N-CA 125.66 1.584 . . . . 0.0 108.893 171.085 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 37.9 mtmt -59.09 139.42 56.89 Favored 'General case' 0 N--CA 1.467 0.42 0 O-C-N 121.224 -0.922 . . . . 0.0 111.167 176.052 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 14.1 tt0 -60.0 -43.19 95.37 Favored 'General case' 0 C--O 1.222 -0.379 0 CA-C-O 119.008 -0.52 . . . . 0.0 110.742 176.524 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 76.4 p -60.05 -34.62 73.66 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 114.403 1.26 . . . . 0.0 114.403 176.467 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 40.9 m-20 -71.15 -45.84 62.71 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.281 1.432 . . . . 0.0 113.893 173.719 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 56.6 t-105 -71.46 -34.79 70.54 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 125.065 1.346 . . . . 0.0 113.834 178.332 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 33.6 t-20 -67.61 -21.81 65.39 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 125.586 1.554 . . . . 0.0 111.881 176.747 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 23.6 mm-40 -89.02 6.51 39.36 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.816 1.246 . . . . 0.0 114.279 169.411 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 2.2 m-70 61.92 23.57 13.89 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 125.79 1.636 . . . . 0.0 113.938 171.66 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 19.2 mtpp -74.56 168.48 19.68 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 125.931 1.693 . . . . 0.0 113.016 -175.774 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 8.3 pm0 -56.72 97.66 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.974 1.71 . . . . 0.0 113.327 -176.632 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 60.6 tp -54.23 -43.26 70.7 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.328 1.451 . . . . 0.0 111.906 -173.807 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -63.01 -33.85 76.31 Favored 'General case' 0 N--CA 1.476 0.859 0 N-CA-C 113.131 0.789 . . . . 0.0 113.131 -176.743 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 29.6 mmtp -88.49 -39.05 14.49 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 123.673 0.789 . . . . 0.0 112.511 175.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 93.6 m -71.83 -35.09 69.79 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 113.274 0.842 . . . . 0.0 113.274 -177.176 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.13 169.98 1.83 Allowed 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.174 0.99 . . . . 0.0 112.07 176.918 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -178.78 177.56 48.49 Favored Glycine 0 N--CA 1.45 -0.399 0 CA-C-N 114.606 -1.179 . . . . 0.0 114.414 166.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 19.3 m -88.88 141.61 14.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 C-N-CA 124.66 1.184 . . . . 0.0 111.542 166.227 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 39.8 p90 -136.5 154.06 76.55 Favored Pre-proline 0 CA--C 1.538 0.518 0 C-N-CA 125.395 1.478 . . . . 0.0 112.187 175.149 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -65.9 112.45 2.24 Favored 'Trans proline' 0 N--CA 1.46 -0.479 0 C-N-CA 121.788 1.659 . . . . 0.0 108.898 170.134 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 18.7 pt-20 -56.28 -30.8 62.96 Favored 'General case' 0 N--CA 1.471 0.604 0 O-C-N 121.346 -0.846 . . . . 0.0 111.459 -178.015 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 8.4 p-10 -63.49 -18.16 63.51 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 126.081 1.752 . . . . 0.0 113.914 178.667 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 9.5 m-85 -74.39 -13.97 60.8 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 116.125 1.898 . . . . 0.0 116.125 166.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 589' ' ' THR . . . . . 0.402 HG22 ' HA ' ' A' ' 527' ' ' ALA . 30.9 p -121.76 176.67 5.62 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 127.043 2.137 . . . . 0.0 112.199 -176.682 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 15.8 pt-20 -131.69 138.51 48.73 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.757 1.223 . . . . 0.0 109.808 168.476 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 591' ' ' ARG . . . . . 0.573 ' HD3' ' CD1' ' A' ' 523' ' ' PHE . 4.0 tpt180 -66.1 120.82 13.85 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 125.304 1.442 . . . . 0.0 111.294 176.252 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 592' ' ' VAL . . . . . 0.443 HG23 ' HB2' ' A' ' 524' ' ' LYS . 3.8 m -108.0 154.46 41.12 Favored Pre-proline 0 N--CA 1.477 0.915 0 C-N-CA 125.241 1.416 . . . . 0.0 109.328 -178.154 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 593' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo . . . . . 0 C--O 1.251 1.172 0 C-N-CA 123.635 2.89 . . . . 0.0 113.526 -174.467 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B 1728 ' ' SER . . . . . . . . . . . . . 41.7 t . . . . . 0 N--CA 1.47 0.56 0 N-CA-C 109.484 -0.562 . . . . 0.0 109.484 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B 1729 ' ' THR . . . . . . . . . . . . . 30.6 p -73.23 -10.69 60.03 Favored 'General case' 0 N--CA 1.479 1.014 0 N-CA-C 115.904 1.816 . . . . 0.0 115.904 -171.275 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B 1730 ' ' VAL . . . . . . . . . . . . . 2.9 m -67.61 143.31 96.8 Favored Pre-proline 0 N--CA 1.476 0.856 0 N-CA-C 113.477 0.918 . . . . 0.0 113.477 -179.121 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -73.19 164.75 34.51 Favored 'Trans proline' 0 CA--C 1.54 0.804 0 C-N-CA 123.927 3.085 . . . . 0.0 112.713 174.369 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 31.6 t -129.78 132.38 65.94 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 C-N-CA 125.73 1.612 . . . . 0.0 110.697 176.745 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -67.4 144.97 98.31 Favored Pre-proline 0 CA--C 1.549 0.939 0 N-CA-C 113.077 0.769 . . . . 0.0 113.077 -172.69 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -77.99 168.66 21.72 Favored 'Trans proline' 0 CA--C 1.548 1.183 0 C-N-CA 122.949 2.433 . . . . 0.0 112.391 175.35 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 77.8 Cg_exo -58.46 157.99 24.79 Favored 'Trans proline' 0 CA--C 1.542 0.906 0 C-N-CA 123.719 2.946 . . . . 0.0 114.357 177.247 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B 1736 ' ' ARG . . . . . . . . . . . . . 11.8 mtp-105 -131.31 164.07 26.43 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 126.045 1.738 . . . . 0.0 112.924 174.351 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B 1737 ' ' ARG . . . . . . . . . . . . . 31.5 mtt85 -135.88 -32.75 0.87 Allowed 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 126.604 1.961 . . . . 0.0 111.714 -172.985 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B 1738 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 58.6 11.25 1.68 Allowed 'General case' 0 N--CA 1.494 1.757 0 C-N-CA 128.106 2.563 . . . . 0.0 116.798 163.231 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B 1739 ' ' ARG . . . . . . . . . . . . . 1.2 tpm_? 54.79 39.23 31.29 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 127.326 2.25 . . . . 0.0 113.348 -162.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B 1740 ' ' GLY . . . . . . . . . . . . . . . -115.07 -167.48 15.4 Favored Glycine 0 CA--C 1.536 1.344 0 C-N-CA 125.794 1.664 . . . . 0.0 112.469 171.828 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B 1741 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.18 86.22 1.9 Allowed 'General case' 0 N--CA 1.476 0.858 0 CA-C-O 122.192 0.996 . . . . 0.0 110.216 173.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B 1742 ' ' ASN . . . . . . . . . . . . . 9.9 p-10 -64.38 161.39 17.04 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.4 1.48 . . . . 0.0 113.346 178.402 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B 1743 ' ' LEU . . . . . . . . . . . . . 1.7 pt? -71.3 148.8 46.76 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 122.96 0.504 . . . . 0.0 111.322 158.43 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B 1744 ' ' THR . . . . . . . . . . . . 0.328 0.2 OUTLIER . . . . . 0 N--CA 1.482 1.132 0 N-CA-C 115.983 1.846 . . . . 0.0 115.983 179.796 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 513' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.119 0 N-CA-C 111.918 -0.473 . . . . 0.0 111.918 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 514' ' ' ARG . . . . . . . . . . . . . 2.2 mmp_? -78.65 160.3 27.59 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 125.979 1.712 . . . . 0.0 114.485 -174.08 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -105.23 -40.39 5.87 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 125.248 1.419 . . . . 0.0 111.355 168.254 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 516' ' ' ASP . . . . . . . . . . . . . 39.2 t0 -73.76 133.83 43.35 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 122.682 1.229 . . . . 0.0 108.79 167.398 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 517' ' ' LEU . . . . . 0.45 HD22 HD22 ' A' ' 548' ' ' LEU . 9.3 mt -136.49 159.61 69.91 Favored Pre-proline 0 CA--C 1.541 0.632 0 C-N-CA 125.644 1.578 . . . . 0.0 111.197 -167.231 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 29.9 Cg_endo -67.89 157.44 61.79 Favored 'Trans proline' 0 CA--C 1.541 0.834 0 C-N-CA 123.362 2.708 . . . . 0.0 113.791 -171.209 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_endo -62.46 127.51 21.06 Favored 'Trans proline' 0 N--CA 1.459 -0.551 0 C-N-CA 123.584 2.856 . . . . 0.0 110.074 179.406 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 76.46 1.92 72.5 Favored Glycine 0 CA--C 1.532 1.155 0 CA-C-O 117.616 -1.658 . . . . 0.0 115.785 -175.711 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 30.1 t80 -36.78 128.28 0.85 Allowed 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 116.912 2.19 . . . . 0.0 116.912 178.013 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 52.3 mtm -100.11 -55.1 2.71 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 123.081 0.552 . . . . 0.0 112.178 -178.489 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 523' ' ' PHE . . . . . . . . . . . . . 24.6 p90 -165.62 170.38 14.27 Favored 'General case' 0 C--O 1.222 -0.345 0 C-N-CA 126.323 1.849 . . . . 0.0 112.654 -172.936 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 524' ' ' LYS . . . . . 0.52 ' HE2' ' CD2' ' A' ' 548' ' ' LEU . 78.5 mttt -102.18 162.9 12.56 Favored 'General case' 0 CA--C 1.538 0.483 0 O-C-N 121.169 -0.957 . . . . 0.0 111.807 169.298 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 17.7 m -136.24 160.98 38.08 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.904 0 C-N-CA 127.21 2.204 . . . . 0.0 108.788 166.19 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 41.3 tt0 -126.23 125.99 43.3 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 119.204 0.911 . . . . 0.0 111.587 175.347 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 527' ' ' ALA . . . . . 0.505 ' HA ' HG22 ' A' ' 589' ' ' THR . . . -58.24 132.84 54.78 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 124.011 0.924 . . . . 0.0 111.391 -179.783 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 84.0 mm-40 -102.46 -23.8 13.89 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 125.941 1.696 . . . . 0.0 112.179 173.201 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 89.9 m-70 -138.13 160.07 40.38 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 126.254 1.822 . . . . 0.0 111.01 -179.05 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -83.1 128.22 34.29 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 125.28 1.432 . . . . 0.0 113.966 -178.912 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 84.9 t80 -130.69 122.65 27.71 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 115.107 1.521 . . . . 0.0 115.107 -176.973 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -95.68 134.77 38.2 Favored 'General case' 0 N--CA 1.48 1.069 0 N-CA-C 115.652 1.723 . . . . 0.0 115.652 174.114 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -74.59 120.51 20.24 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-O 122.12 0.962 . . . . 0.0 112.947 -175.817 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 4.4 t -90.79 6.98 42.05 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 126.836 2.054 . . . . 0.0 115.84 179.894 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -153.23 155.13 36.04 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 129.172 2.989 . . . . 0.0 111.685 -178.61 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 536' ' ' THR . . . . . . . . . . . . 0.264 0.9 OUTLIER -65.38 -25.56 67.62 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 116.124 1.898 . . . . 0.0 116.124 177.16 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 90.2 m-20 -92.74 -8.58 43.39 Favored 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 115.47 1.656 . . . . 0.0 115.47 175.594 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -74.47 146.46 42.77 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.767 1.227 . . . . 0.0 110.909 174.447 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -84.9 159.4 20.34 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 126.398 1.879 . . . . 0.0 110.202 174.637 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 17.8 tt0 -118.84 138.6 52.61 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.454 1.502 . . . . 0.0 110.658 173.844 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 91.3 mt -133.2 141.23 47.98 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 125.082 1.353 . . . . 0.0 111.953 -174.79 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.23 143.28 40.61 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 125.063 1.345 . . . . 0.0 108.507 164.812 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -53.83 117.8 3.46 Favored 'General case' 0 CA--C 1.548 0.894 0 O-C-N 121.633 -0.667 . . . . 0.0 111.94 -179.868 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 110.85 -9.71 29.77 Favored Glycine 0 CA--C 1.532 1.109 0 C-N-CA 126.772 2.13 . . . . 0.0 113.939 -175.347 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 69.0 m-20 -74.83 121.44 21.82 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 118.689 1.245 . . . . 0.0 113.377 -173.881 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 2.7 t -72.31 136.1 26.37 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 O-C-N 121.713 -0.617 . . . . 0.0 112.071 172.393 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -124.08 122.27 63.99 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.6 0 C-N-CA 126.16 1.784 . . . . 0.0 111.428 175.93 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 548' ' ' LEU . . . . . 0.52 ' CD2' ' HE2' ' A' ' 524' ' ' LYS . 20.0 mt -78.37 99.42 6.36 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.637 1.175 . . . . 0.0 108.637 174.983 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 549' ' ' VAL . . . . . . . . . . . . . 6.1 t -60.92 133.12 26.7 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.268 0 N-CA-C 114.583 1.327 . . . . 0.0 114.583 172.984 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 16.8 pt -130.42 156.17 79.95 Favored Pre-proline 0 CA--C 1.55 0.958 0 C-N-CA 126.77 2.028 . . . . 0.0 110.428 177.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 92.3 Cg_endo -72.19 165.55 32.3 Favored 'Trans proline' 0 CA--C 1.536 0.596 0 C-N-CA 124.194 3.263 . . . . 0.0 111.638 173.024 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 66.0 m-85 -85.14 158.79 20.3 Favored 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 116.28 1.956 . . . . 0.0 116.28 -177.692 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 553' ' ' GLN . . . . . 0.498 ' CD ' ' H ' ' A' ' 553' ' ' GLN . 0.1 OUTLIER -76.93 -20.3 56.34 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 124.789 1.235 . . . . 0.0 114.03 167.399 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 13.0 m-20 -154.31 149.78 21.05 Favored Pre-proline 0 CA--C 1.539 0.538 0 C-N-CA 124.623 1.169 . . . . 0.0 112.034 173.576 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 555' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -64.92 -29.4 57.99 Favored 'Trans proline' 0 CA--C 1.539 0.773 0 C-N-CA 123.482 2.788 . . . . 0.0 112.569 174.54 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 17.1 pt-20 -82.92 -6.01 59.28 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 125.87 1.668 . . . . 0.0 114.476 171.934 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 557' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -88.2 -10.21 50.54 Favored 'General case' 0 N--CA 1.478 0.949 0 N-CA-C 114.578 1.325 . . . . 0.0 114.578 167.49 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 4.5 tp60 -82.03 148.97 28.34 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 124.237 1.015 . . . . 0.0 112.072 164.181 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -113.33 141.9 46.49 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 128.146 2.578 . . . . 0.0 113.607 171.169 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 82.5 tt0 -64.42 120.34 12.08 Favored 'General case' 0 N--CA 1.478 0.948 0 O-C-N 119.654 -1.904 . . . . 0.0 112.032 -171.168 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 85.13 5.71 85.42 Favored Glycine 0 CA--C 1.539 1.576 0 C-N-CA 124.897 1.237 . . . . 0.0 115.826 -175.42 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 562' ' ' TRP . . . . . 0.422 ' CZ2' ' HD3' ' B' 1736 ' ' ARG . 41.1 m95 -94.33 173.21 7.75 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 125.386 1.474 . . . . 0.0 113.86 178.396 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 17.3 mt -139.92 154.34 47.21 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 125.137 1.375 . . . . 0.0 110.618 166.704 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 31.4 tpp -107.34 143.33 35.78 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 125.28 1.432 . . . . 0.0 110.932 168.731 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -169.41 -172.42 36.04 Favored Glycine 0 CA--C 1.526 0.742 0 C-N-CA 124.38 0.991 . . . . 0.0 112.607 174.376 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 12.0 p -134.22 140.41 46.13 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.568 0 C-N-CA 125.569 1.548 . . . . 0.0 109.124 173.586 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 35.9 mtmt -56.39 136.16 53.79 Favored 'General case' 0 N--CA 1.468 0.428 0 O-C-N 121.24 -0.913 . . . . 0.0 111.356 176.347 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 52.3 tt0 -61.57 -42.41 98.8 Favored 'General case' 0 C--O 1.22 -0.449 0 CA-C-O 117.868 -1.063 . . . . 0.0 110.71 176.355 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 40.1 t -58.58 -37.2 75.26 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 119.696 1.135 . . . . 0.0 112.501 174.634 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 73.6 m-20 -63.75 -44.27 94.0 Favored 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 114.771 1.397 . . . . 0.0 114.771 172.516 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 55.3 t-105 -75.35 -29.36 59.91 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 124.941 1.296 . . . . 0.0 113.634 177.953 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 5.6 t-20 -68.44 -33.51 74.34 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 126.638 1.975 . . . . 0.0 110.711 172.873 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 30.5 mm100 -79.06 -3.7 46.54 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 124.636 1.174 . . . . 0.0 113.92 167.945 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 574' ' ' HIS . . . . . . . . . . . . 0.283 86.4 m-70 64.13 31.93 13.0 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 127.605 2.362 . . . . 0.0 115.547 168.65 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 78.2 mttt -66.6 170.87 5.69 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 127.566 2.346 . . . . 0.0 114.108 -178.225 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 21.4 pt-20 -59.95 104.65 0.32 Allowed 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 124.629 1.172 . . . . 0.0 113.031 171.738 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 57.7 tp -55.74 -42.84 75.98 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 124.226 1.01 . . . . 0.0 112.421 -171.204 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 2.8 pt-20 -61.86 -30.48 70.88 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 114.73 1.381 . . . . 0.0 114.73 -176.131 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 28.2 mmmt -97.47 -30.68 12.76 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 123.547 0.739 . . . . 0.0 112.819 -179.677 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 32.8 m -70.27 -40.39 74.36 Favored 'General case' 0 CA--C 1.538 0.492 0 N-CA-C 113.507 0.928 . . . . 0.0 113.507 173.141 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 29.6 ptt85 -64.39 161.81 16.26 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 123.867 0.867 . . . . 0.0 112.781 178.374 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -175.44 173.39 46.21 Favored Glycine 0 CA--C 1.52 0.354 0 CA-C-N 115.4 -0.818 . . . . 0.0 114.032 174.15 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 30.1 m -87.87 143.7 10.74 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.274 0 C-N-CA 123.262 0.625 . . . . 0.0 110.199 171.76 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 45.4 p90 -143.55 156.58 60.02 Favored Pre-proline 0 CA--C 1.541 0.629 0 C-N-CA 124.742 1.217 . . . . 0.0 112.346 176.7 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -69.75 111.21 2.75 Favored 'Trans proline' 0 C--N 1.347 0.49 0 C-N-CA 122.291 1.994 . . . . 0.0 109.903 172.762 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 19.6 pt-20 -55.82 -29.71 60.23 Favored 'General case' 0 N--CA 1.475 0.806 0 O-C-N 121.547 -0.721 . . . . 0.0 112.076 -179.07 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 10.9 p-10 -66.32 -20.97 66.24 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 125.604 1.561 . . . . 0.0 114.001 178.612 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 14.0 m-85 -69.07 -14.46 63.03 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 116.717 2.117 . . . . 0.0 116.717 164.605 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 589' ' ' THR . . . . . 0.505 HG22 ' HA ' ' A' ' 527' ' ' ALA . 63.5 p -122.0 173.43 7.54 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 126.277 1.831 . . . . 0.0 111.097 -176.357 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 15.1 pt-20 -126.55 136.34 52.44 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 124.245 1.018 . . . . 0.0 109.001 173.474 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.41 128.22 35.6 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 124.247 1.019 . . . . 0.0 108.692 178.606 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 592' ' ' VAL . . . . . 0.459 HG23 ' HB2' ' A' ' 524' ' ' LYS . 1.9 m -110.76 150.7 42.16 Favored Pre-proline 0 CA--C 1.548 0.886 0 C-N-CA 125.624 1.57 . . . . 0.0 107.666 178.019 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 593' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_exo . . . . . 0 C--O 1.254 1.282 1 C-N-CA 126.52 4.814 . . . . 0.0 116.431 -174.537 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B 1728 ' ' SER . . . . . . . . . . . . . 42.3 t . . . . . 0 N--CA 1.475 0.804 0 CA-C-O 118.052 -0.975 . . . . 0.0 111.859 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B 1729 ' ' THR . . . . . . . . . . . . 0.41 0.3 OUTLIER -125.99 -6.61 6.67 Favored 'General case' 0 N--CA 1.487 1.407 0 N-CA-C 118.139 2.644 . . . . 0.0 118.139 -177.248 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B 1730 ' ' VAL . . . . . . . . . . . . . 1.3 m -139.94 139.51 21.77 Favored Pre-proline 0 CA--C 1.546 0.822 0 C-N-CA 126.32 1.848 . . . . 0.0 114.436 173.884 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 68.5 Cg_endo -73.36 168.76 23.93 Favored 'Trans proline' 0 CA--C 1.543 0.974 0 C-N-CA 123.837 3.025 . . . . 0.0 113.633 -179.744 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 16.0 t -128.74 126.14 64.51 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.126 0 C-N-CA 125.194 1.398 . . . . 0.0 112.495 -177.081 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -65.79 129.12 94.25 Favored Pre-proline 0 CA--C 1.55 0.969 0 O-C-N 121.533 -0.729 . . . . 0.0 111.475 -178.542 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 26.6 Cg_endo -69.42 157.16 62.07 Favored 'Trans proline' 0 CA--C 1.544 0.985 0 C-N-CA 122.165 1.91 . . . . 0.0 112.718 -173.847 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -63.95 122.27 10.24 Favored 'Trans proline' 0 CA--C 1.538 0.682 0 C-N-CA 123.054 2.503 . . . . 0.0 111.944 -174.809 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B 1736 ' ' ARG . . . . . 0.422 ' HD3' ' CZ2' ' A' ' 562' ' ' TRP . 36.0 mtm180 -87.28 150.86 23.59 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 125.471 1.508 . . . . 0.0 110.724 179.952 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B 1737 ' ' ARG . . . . . . . . . . . . . 10.9 mmt85 -98.7 -72.53 0.65 Allowed 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 124.495 1.118 . . . . 0.0 112.801 -169.07 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B 1738 ' ' ARG . . . . . . . . . . . . . 15.5 ptt-85 -152.48 -25.75 0.17 Allowed 'General case' 0 N--CA 1.486 1.344 0 N-CA-C 116.062 1.875 . . . . 0.0 116.062 179.783 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B 1739 ' ' ARG . . . . . . . . . . . . . 2.9 ttp85 47.42 65.78 1.18 Allowed 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 127.316 2.246 . . . . 0.0 114.393 175.188 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B 1740 ' ' GLY . . . . . . . . . . . . . . . 75.15 15.45 81.11 Favored Glycine 0 CA--C 1.54 1.649 0 N-CA-C 116.691 1.436 . . . . 0.0 116.691 174.854 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B 1741 ' ' ARG . . . . . . . . . . . . . 8.8 tpm_? -131.56 94.78 3.6 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 125.334 1.453 . . . . 0.0 111.439 175.775 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B 1742 ' ' ASN . . . . . . . . . . . . . 10.3 p30 -68.61 158.78 33.31 Favored 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 123.56 0.744 . . . . 0.0 112.043 176.066 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B 1743 ' ' LEU . . . . . . . . . . . . . 55.8 tp -64.09 131.58 47.95 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.536 1.134 . . . . 0.0 113.989 -171.516 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B 1744 ' ' THR . . . . . . . . . . . . . 4.4 p . . . . . 0 C--O 1.252 1.211 0 C-N-CA 126.944 2.097 . . . . 0.0 115.823 -179.421 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 513' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.904 0 N-CA-C 110.838 -0.905 . . . . 0.0 110.838 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 514' ' ' ARG . . . . . . . . . . . . . 13.9 ptm180 -69.64 -31.14 69.06 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 114.802 1.408 . . . . 0.0 114.802 -169.999 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 54.6 mt 57.35 -26.62 0.02 OUTLIER 'General case' 0 CA--C 1.553 1.063 0 C-N-CA 128.345 2.658 . . . . 0.0 117.58 -172.589 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 516' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -73.18 161.98 29.94 Favored 'General case' 0 CA--C 1.545 0.773 0 CA-C-N 120.017 1.28 . . . . 0.0 111.336 179.172 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 517' ' ' LEU . . . . . 0.475 HD22 HD22 ' A' ' 548' ' ' LEU . 14.0 mt -128.69 160.39 63.15 Favored Pre-proline 0 CA--C 1.543 0.687 0 C-N-CA 125.015 1.326 . . . . 0.0 113.419 -162.413 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_endo -66.2 159.53 49.29 Favored 'Trans proline' 0 CA--C 1.538 0.708 0 C-N-CA 123.923 3.082 . . . . 0.0 114.241 -174.039 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 96.1 Cg_endo -68.36 130.15 20.56 Favored 'Trans proline' 0 N--CA 1.457 -0.622 0 C-N-CA 123.366 2.71 . . . . 0.0 109.628 -179.742 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 78.84 1.23 83.9 Favored Glycine 0 CA--C 1.537 1.454 0 CA-C-O 116.777 -2.124 . . . . 0.0 115.578 -175.441 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 22.2 t80 -36.42 133.13 0.54 Allowed 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 117.63 2.456 . . . . 0.0 117.63 -179.751 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 31.0 mtm -100.58 -57.78 2.04 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 123.065 0.546 . . . . 0.0 111.949 -177.005 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 523' ' ' PHE . . . . . 0.463 ' CE1' HG21 ' A' ' 549' ' ' VAL . 20.3 p90 -166.68 175.09 8.15 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 126.911 2.084 . . . . 0.0 112.46 -173.233 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 524' ' ' LYS . . . . . 0.498 ' HG2' HD23 ' A' ' 548' ' ' LEU . 66.6 mttt -107.35 162.69 13.68 Favored 'General case' 0 N--CA 1.476 0.867 0 O-C-N 120.169 -1.582 . . . . 0.0 112.178 168.629 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 5.1 m -133.33 162.5 39.68 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 C-N-CA 126.905 2.082 . . . . 0.0 109.768 164.057 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 42.5 tt0 -128.71 130.45 47.15 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-N 118.868 0.758 . . . . 0.0 111.924 169.305 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 527' ' ' ALA . . . . . 0.519 ' HA ' HG22 ' A' ' 589' ' ' THR . . . -60.92 127.36 31.18 Favored 'General case' 0 N--CA 1.466 0.353 0 O-C-N 121.124 -0.985 . . . . 0.0 111.548 -179.677 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 61.6 mm-40 -89.94 -25.45 20.92 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 125.308 1.443 . . . . 0.0 111.973 171.984 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 96.5 m-70 -142.44 163.77 31.94 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 126.974 2.109 . . . . 0.0 110.257 -172.944 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 35.8 m-20 -80.03 137.4 36.8 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 123.845 0.858 . . . . 0.0 111.726 177.474 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 89.2 t80 -134.36 121.3 20.99 Favored 'General case' 0 C--O 1.236 0.358 0 N-CA-C 114.065 1.135 . . . . 0.0 114.065 175.18 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -88.22 117.11 26.9 Favored 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 115.289 1.589 . . . . 0.0 115.289 173.701 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -67.77 123.68 21.2 Favored 'General case' 0 CA--C 1.537 0.468 0 O-C-N 121.898 -0.501 . . . . 0.0 110.902 171.336 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 6.2 t -115.9 -2.04 12.43 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 126.575 1.95 . . . . 0.0 114.242 -177.281 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 39.5 m-20 -113.73 156.56 23.58 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 125.713 1.605 . . . . 0.0 115.108 157.135 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 6.7 t -59.26 -29.09 67.31 Favored 'General case' 0 CA--C 1.545 0.785 0 N-CA-C 114.33 1.234 . . . . 0.0 114.33 170.584 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -70.42 -20.17 62.94 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 116.862 2.171 . . . . 0.0 116.862 169.467 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 82.1 mt-10 -85.05 149.93 25.22 Favored 'General case' 0 CA--C 1.542 0.651 0 O-C-N 120.671 -1.268 . . . . 0.0 113.95 -170.453 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -99.89 127.83 46.03 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 126.531 1.932 . . . . 0.0 110.663 179.134 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 14.1 tt0 -88.11 127.85 35.42 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 123.47 0.708 . . . . 0.0 111.473 -179.517 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 71.1 mt -119.34 140.7 49.91 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 124.58 1.152 . . . . 0.0 111.932 -177.426 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 14.4 tppt? -107.26 138.28 43.75 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 125.883 1.673 . . . . 0.0 109.063 164.649 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -49.57 114.32 1.02 Allowed 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.771 0.829 . . . . 0.0 110.872 175.173 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 107.52 -4.89 34.99 Favored Glycine 0 CA--C 1.534 1.238 0 C-N-CA 126.693 2.092 . . . . 0.0 114.677 -175.607 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 77.0 m-20 -70.0 120.46 15.75 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 119.734 1.767 . . . . 0.0 114.958 176.546 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 27.4 t -70.92 135.23 28.5 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 CA-C-N 118.539 0.609 . . . . 0.0 110.128 166.569 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 1.4 t -126.07 121.59 59.74 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.404 0 C-N-CA 125.547 1.539 . . . . 0.0 110.474 175.375 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 548' ' ' LEU . . . . . 0.498 HD23 ' HG2' ' A' ' 524' ' ' LYS . 30.6 mt -78.93 104.81 9.81 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 107.937 -1.135 . . . . 0.0 107.937 175.627 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 549' ' ' VAL . . . . . 0.463 HG21 ' CE1' ' A' ' 523' ' ' PHE . 30.9 t -61.03 131.71 26.14 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.901 0 CA-C-O 121.942 0.877 . . . . 0.0 113.17 170.743 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 5.6 pt -126.11 157.11 70.79 Favored Pre-proline 0 CA--C 1.542 0.672 0 C-N-CA 126.582 1.953 . . . . 0.0 108.504 175.936 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -66.62 145.89 77.51 Favored 'Trans proline' 0 N--CA 1.458 -0.595 0 C-N-CA 122.905 2.403 . . . . 0.0 110.74 176.147 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 32.8 m-85 -58.64 138.96 56.63 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 115.09 1.515 . . . . 0.0 115.09 177.912 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 553' ' ' GLN . . . . . . . . . . . . . 19.4 pt20 -66.2 -25.82 67.1 Favored 'General case' 0 N--CA 1.467 0.383 0 N-CA-C 113.627 0.973 . . . . 0.0 113.627 -177.43 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 58.2 m-20 -142.23 142.49 24.29 Favored Pre-proline 0 CA--C 1.544 0.725 0 C-N-CA 125.583 1.553 . . . . 0.0 110.293 167.497 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 555' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_endo -67.13 -34.39 28.48 Favored 'Trans proline' 0 CA--C 1.536 0.614 0 C-N-CA 123.671 2.914 . . . . 0.0 111.185 175.471 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 19.1 pt-20 -68.81 -14.11 62.82 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.91 1.284 . . . . 0.0 113.518 174.582 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 557' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -86.43 -21.45 27.09 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 114.145 1.165 . . . . 0.0 114.145 174.221 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 35.6 tt0 -66.21 121.91 16.27 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 113.37 0.878 . . . . 0.0 113.37 -174.628 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 66.5 m-20 -95.13 146.6 24.19 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 127.945 2.498 . . . . 0.0 113.277 176.999 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -81.55 133.9 35.44 Favored 'General case' 0 N--CA 1.472 0.664 0 O-C-N 120.364 -1.46 . . . . 0.0 113.349 -173.843 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 76.9 -1.02 64.22 Favored Glycine 0 CA--C 1.538 1.522 0 C-N-CA 124.025 0.822 . . . . 0.0 114.282 -169.841 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 57.9 m95 -97.07 158.71 15.3 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 125.859 1.663 . . . . 0.0 112.056 174.989 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -135.03 156.47 48.98 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 126.993 2.117 . . . . 0.0 109.486 176.884 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 51.5 ttm -119.01 141.28 48.82 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 124.285 1.034 . . . . 0.0 112.004 175.646 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -171.06 -172.08 36.93 Favored Glycine 0 CA--C 1.524 0.625 0 C-N-CA 123.817 0.722 . . . . 0.0 113.267 179.773 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 12.7 p -133.47 139.94 47.89 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 C-N-CA 126.23 1.812 . . . . 0.0 109.189 173.087 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 34.9 mtmt -57.24 136.61 56.49 Favored 'General case' 0 N--CA 1.469 0.479 0 O-C-N 121.086 -1.009 . . . . 0.0 111.308 175.865 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -60.59 -39.43 88.08 Favored 'General case' 0 CA--C 1.539 0.552 0 O-C-N 122.012 -0.43 . . . . 0.0 110.714 174.914 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 34.2 t -71.13 -14.16 62.19 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 113.911 1.078 . . . . 0.0 113.911 176.073 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 72.5 m-20 -83.68 -45.22 13.66 Favored 'General case' 0 CA--C 1.541 0.626 0 O-C-N 120.709 -1.244 . . . . 0.0 113.848 166.465 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 61.4 t-105 -71.39 -37.76 71.55 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.952 1.301 . . . . 0.0 114.293 179.377 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 7.0 t-20 -67.17 -13.8 62.3 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 124.808 1.243 . . . . 0.0 112.027 174.858 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 5.2 mm-40 -91.48 1.58 57.03 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 125.333 1.453 . . . . 0.0 114.395 171.217 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 48.1 m-70 60.11 35.25 21.24 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 125.275 1.43 . . . . 0.0 112.935 177.84 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 26.6 mtpp -91.58 163.19 14.22 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 125.943 1.697 . . . . 0.0 111.983 -175.829 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 10.7 pm0 -56.37 99.6 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 125.37 1.468 . . . . 0.0 114.618 -170.243 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 54.8 tp -56.22 -46.04 79.66 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 124.186 0.994 . . . . 0.0 111.718 -173.631 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 -62.73 -14.44 44.51 Favored 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 115.095 1.517 . . . . 0.0 115.095 -178.847 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 33.8 mmtp -112.48 -35.88 5.42 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.752 1.221 . . . . 0.0 113.321 175.205 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 83.0 m -67.04 -24.12 65.96 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.163 0.985 . . . . 0.0 112.297 175.517 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 17.3 ptt180 -68.49 149.75 48.89 Favored 'General case' 0 N--CA 1.47 0.526 0 N-CA-C 113.348 0.869 . . . . 0.0 113.348 175.057 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -164.44 172.59 40.25 Favored Glycine 0 CA--C 1.528 0.875 0 CA-C-N 114.598 -1.183 . . . . 0.0 113.917 174.255 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 28.4 m -92.31 143.48 11.28 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 C-N-CA 124.906 1.282 . . . . 0.0 112.108 170.339 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 45.8 p90 -138.6 154.56 73.37 Favored Pre-proline 0 CA--C 1.546 0.789 0 C-N-CA 124.786 1.234 . . . . 0.0 113.949 176.282 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -65.78 113.85 2.71 Favored 'Trans proline' 0 C--N 1.35 0.618 0 C-N-CA 122.924 2.416 . . . . 0.0 110.291 169.672 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 20.1 pt-20 -60.08 -26.0 65.84 Favored 'General case' 0 N--CA 1.479 1.002 0 O-C-N 121.493 -0.754 . . . . 0.0 112.203 -175.136 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 11.2 p-10 -71.92 -18.49 62.02 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 126.969 2.108 . . . . 0.0 113.799 -179.576 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 19.7 m-85 -72.23 -12.19 61.06 Favored 'General case' 0 N--CA 1.467 0.395 0 N-CA-C 116.276 1.954 . . . . 0.0 116.276 166.496 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 589' ' ' THR . . . . . 0.519 HG22 ' HA ' ' A' ' 527' ' ' ALA . 69.5 p -128.25 168.39 15.55 Favored 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 125.536 1.534 . . . . 0.0 110.658 -174.354 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 16.3 pt-20 -122.35 137.15 54.95 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 124.124 0.97 . . . . 0.0 109.976 174.798 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 15.3 tpp85 -64.32 131.58 47.69 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 124.706 1.202 . . . . 0.0 109.94 177.619 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 592' ' ' VAL . . . . . 0.435 HG23 ' HB2' ' A' ' 524' ' ' LYS . 2.9 m -126.4 156.86 72.09 Favored Pre-proline 0 N--CA 1.482 1.13 0 C-N-CA 125.645 1.578 . . . . 0.0 110.232 -177.545 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 593' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_endo . . . . . 0 C--O 1.252 1.202 0 C-N-CA 124.511 3.474 . . . . 0.0 113.954 -176.578 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B 1728 ' ' SER . . . . . . . . . . . . . 42.2 t . . . . . 0 N--CA 1.471 0.601 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B 1729 ' ' THR . . . . . . . . . . . . 0.28 1.4 p -64.9 -24.07 67.42 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 115.601 1.704 . . . . 0.0 115.601 172.031 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B 1730 ' ' VAL . . . . . . . . . . . . . 27.1 m -141.5 154.43 66.68 Favored Pre-proline 0 N--CA 1.478 0.974 0 C-N-CA 126.357 1.863 . . . . 0.0 111.18 -179.733 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 98.9 Cg_endo -71.68 167.11 27.42 Favored 'Trans proline' 0 CA--C 1.541 0.826 0 C-N-CA 122.809 2.339 . . . . 0.0 113.19 170.61 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 6.5 t -128.45 140.37 49.4 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.875 0 C-N-CA 126.153 1.781 . . . . 0.0 111.968 172.141 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -67.16 139.19 95.0 Favored Pre-proline 0 CA--C 1.55 0.965 0 O-C-N 121.518 -0.739 . . . . 0.0 112.835 -178.112 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -75.82 162.99 34.27 Favored 'Trans proline' 0 CA--C 1.543 0.967 0 C-N-CA 122.866 2.377 . . . . 0.0 113.204 -178.823 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 64.5 Cg_endo -69.23 149.14 69.91 Favored 'Trans proline' 0 CA--C 1.539 0.772 0 C-N-CA 123.602 2.868 . . . . 0.0 112.408 179.661 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B 1736 ' ' ARG . . . . . . . . . . . . . 56.6 mtp180 -112.53 149.59 32.48 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 126.31 1.844 . . . . 0.0 112.41 -178.514 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B 1737 ' ' ARG . . . . . . . . . . . . . 79.4 mtt180 -82.25 143.43 31.35 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 126.398 1.879 . . . . 0.0 111.665 -176.377 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B 1738 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.14 141.89 39.95 Favored 'General case' 0 N--CA 1.479 1.01 0 CA-C-O 121.097 0.475 . . . . 0.0 110.683 165.153 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B 1739 ' ' ARG . . . . . . . . . . . . . 81.4 mtt180 -106.02 160.9 14.94 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 126.238 1.815 . . . . 0.0 112.382 -172.241 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B 1740 ' ' GLY . . . . . . . . . . . . . . . 116.23 -3.43 20.48 Favored Glycine 0 CA--C 1.535 1.3 0 C-N-CA 124.936 1.255 . . . . 0.0 116.225 167.632 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B 1741 ' ' ARG . . . . . . . . . . . . . 29.5 ptt-85 -148.72 29.82 0.83 Allowed 'General case' 0 N--CA 1.484 1.234 0 CA-C-N 119.627 1.714 . . . . 0.0 113.828 171.227 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B 1742 ' ' ASN . . . . . . . . . . . . . 18.8 p-10 -102.01 161.48 13.65 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 126.039 1.736 . . . . 0.0 114.091 -177.328 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B 1743 ' ' LEU . . . . . . . . . . . . . 27.0 mt 64.92 28.94 12.59 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 127.261 2.224 . . . . 0.0 116.21 178.682 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B 1744 ' ' THR . . . . . . . . . . . . 0.351 0.2 OUTLIER . . . . . 0 N--CA 1.484 1.236 0 N-CA-C 119.088 2.995 . . . . 0.0 119.088 168.259 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 513' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.539 0 N-CA-C 112.023 -0.431 . . . . 0.0 112.023 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 514' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -108.65 172.74 6.66 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 125.921 1.688 . . . . 0.0 114.124 -171.148 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 67.0 mt -124.53 -17.65 5.94 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 125.736 1.614 . . . . 0.0 114.72 -164.495 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 516' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -107.94 155.3 20.46 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 127.416 2.287 . . . . 0.0 114.735 178.652 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 517' ' ' LEU . . . . . 0.456 HD22 HD22 ' A' ' 548' ' ' LEU . 10.8 mt -131.61 160.62 66.6 Favored Pre-proline 0 CA--C 1.542 0.642 0 C-N-CA 126.272 1.829 . . . . 0.0 111.69 -172.92 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -68.25 159.09 54.74 Favored 'Trans proline' 0 CA--C 1.54 0.795 0 C-N-CA 123.302 2.668 . . . . 0.0 114.025 -172.737 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -61.61 129.96 29.84 Favored 'Trans proline' 0 N--CA 1.458 -0.607 0 C-N-CA 123.609 2.873 . . . . 0.0 110.998 178.856 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 75.79 1.11 66.0 Favored Glycine 0 CA--C 1.536 1.405 0 CA-C-O 117.294 -1.836 . . . . 0.0 115.893 -177.203 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 30.4 t80 -37.18 128.87 0.95 Allowed 'General case' 0 C--N 1.349 0.578 0 N-CA-C 117.155 2.28 . . . . 0.0 117.155 -179.405 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 56.1 mtm -100.01 -53.87 3.04 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 123.943 0.897 . . . . 0.0 113.025 -177.876 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 523' ' ' PHE . . . . . 0.4 ' CE2' HG21 ' A' ' 549' ' ' VAL . 29.1 p90 -165.93 170.67 13.46 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 126.497 1.919 . . . . 0.0 112.974 -174.159 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 524' ' ' LYS . . . . . 0.523 ' HE2' ' CD2' ' A' ' 548' ' ' LEU . 80.0 mttt -101.86 161.98 13.26 Favored 'General case' 0 N--CA 1.467 0.394 0 O-C-N 121.131 -0.981 . . . . 0.0 112.148 168.189 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 15.3 m -132.84 162.82 39.33 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 C-N-CA 126.471 1.909 . . . . 0.0 109.691 164.987 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 55.5 tt0 -127.12 130.62 50.18 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 118.827 0.739 . . . . 0.0 111.548 170.04 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 527' ' ' ALA . . . . . . . . . . . . . . . -59.53 130.9 49.15 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 123.693 0.797 . . . . 0.0 111.359 176.246 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 31.7 mm-40 -93.9 -25.79 17.16 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.372 1.469 . . . . 0.0 110.604 168.585 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 62.7 m-70 -132.55 164.86 25.69 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 127.03 2.132 . . . . 0.0 111.903 -176.691 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -85.07 132.27 34.34 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 106.504 -1.665 . . . . 0.0 106.504 175.891 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 90.0 t80 -120.62 109.99 15.9 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 124.071 0.948 . . . . 0.0 113.134 172.093 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 1.2 m -84.93 108.16 17.43 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 115.178 1.547 . . . . 0.0 115.178 173.638 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -64.25 144.38 57.19 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 125.951 1.7 . . . . 0.0 112.707 178.99 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 2.2 t -125.43 11.35 8.02 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 126.864 2.066 . . . . 0.0 115.44 -177.067 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 28.4 t0 -143.69 157.54 44.33 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 125.808 1.643 . . . . 0.0 107.619 177.595 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 3.2 t -69.93 -21.33 63.29 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 114.681 1.363 . . . . 0.0 114.681 165.036 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 22.9 m-20 -73.46 -19.96 60.82 Favored 'General case' 0 CA--C 1.541 0.635 0 N-CA-C 115.105 1.52 . . . . 0.0 115.105 169.497 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 73.5 mt-10 -87.13 142.34 27.99 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 125.774 1.63 . . . . 0.0 114.553 -177.425 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -88.41 131.76 34.73 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 126.717 2.007 . . . . 0.0 110.035 174.763 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -85.28 133.9 34.14 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 123.614 0.765 . . . . 0.0 110.797 172.344 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 77.0 mt -124.86 147.92 48.53 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.586 1.154 . . . . 0.0 111.957 175.574 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 7.8 tmtt? -115.47 142.98 45.99 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 126.179 1.792 . . . . 0.0 108.147 164.899 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -48.0 123.75 6.63 Favored 'General case' 0 CA--C 1.544 0.735 0 CA-C-N 119.167 0.894 . . . . 0.0 111.068 177.083 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 95.26 0.65 63.11 Favored Glycine 0 CA--C 1.534 1.245 0 C-N-CA 125.477 1.513 . . . . 0.0 114.526 -177.45 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 81.9 m-20 -72.59 119.25 16.55 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 119.249 1.525 . . . . 0.0 113.645 176.107 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 3.4 t -71.89 137.13 24.26 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.573 0 O-C-N 122.126 -0.359 . . . . 0.0 111.321 169.585 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 1.4 t -129.1 124.5 60.78 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.544 0 C-N-CA 125.625 1.57 . . . . 0.0 111.57 177.753 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 548' ' ' LEU . . . . . 0.523 ' CD2' ' HE2' ' A' ' 524' ' ' LYS . 16.7 mt -82.48 99.8 9.69 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.883 1.273 . . . . 0.0 108.581 176.756 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 549' ' ' VAL . . . . . 0.4 HG21 ' CE2' ' A' ' 523' ' ' PHE . 5.1 t -63.41 132.79 29.35 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.198 0 N-CA-C 114.692 1.367 . . . . 0.0 114.692 175.333 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 11.3 pt -129.22 156.55 78.15 Favored Pre-proline 0 CA--C 1.548 0.901 0 C-N-CA 127.09 2.156 . . . . 0.0 110.002 177.765 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -75.39 148.91 34.42 Favored 'Trans proline' 0 CA--C 1.534 0.513 0 C-N-CA 123.918 3.078 . . . . 0.0 112.058 175.678 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 552' ' ' PHE . . . . . 0.445 ' CE1' ' HA ' ' A' ' 558' ' ' GLN . 14.9 m-85 -74.55 143.78 44.34 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 114.368 1.248 . . . . 0.0 114.368 179.163 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 553' ' ' GLN . . . . . . . . . . . . . 17.7 pm0 -62.45 -25.44 67.98 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 125.787 1.635 . . . . 0.0 115.031 175.027 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 9.8 m-20 -150.45 150.27 28.42 Favored Pre-proline 0 CA--C 1.536 0.423 0 C-N-CA 125.215 1.406 . . . . 0.0 112.298 -176.63 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 555' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -66.77 -35.63 27.03 Favored 'Trans proline' 0 CA--C 1.537 0.645 0 C-N-CA 123.091 2.527 . . . . 0.0 112.061 177.153 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -72.86 -24.99 60.94 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.254 1.205 . . . . 0.0 114.254 175.138 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 557' ' ' GLU . . . . . . . . . . . . . 67.6 mm-40 -73.36 -22.53 60.26 Favored 'General case' 0 N--CA 1.473 0.714 0 O-C-N 121.451 -0.781 . . . . 0.0 112.624 171.61 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 558' ' ' GLN . . . . . 0.445 ' HA ' ' CE1' ' A' ' 552' ' ' PHE . 29.9 tt0 -78.57 153.43 31.21 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 124.432 1.093 . . . . 0.0 112.276 173.132 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -142.31 144.41 33.23 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 125.83 1.652 . . . . 0.0 114.746 -179.702 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 39.0 tp10 -68.39 129.53 40.19 Favored 'General case' 0 CA--C 1.537 0.449 0 O-C-N 121.382 -0.824 . . . . 0.0 111.934 -176.526 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 83.31 -6.77 70.63 Favored Glycine 0 CA--C 1.537 1.428 0 C-N-CA 124.76 1.172 . . . . 0.0 114.436 -175.06 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 61.9 m95 -93.09 160.81 14.69 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 125.08 1.352 . . . . 0.0 112.688 174.63 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 14.0 mt -138.08 153.44 49.3 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 126.047 1.739 . . . . 0.0 109.332 168.712 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 54.4 ttm -109.69 143.51 39.37 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 124.184 0.993 . . . . 0.0 111.277 173.54 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -172.45 -171.84 37.68 Favored Glycine 0 CA--C 1.522 0.479 0 C-N-CA 123.699 0.666 . . . . 0.0 112.758 176.907 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 12.0 p -131.77 138.68 52.26 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.503 0 C-N-CA 125.03 1.332 . . . . 0.0 108.65 171.434 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 35.5 mtmt -59.18 136.71 58.04 Favored 'General case' 0 N--CA 1.467 0.404 0 O-C-N 121.272 -0.892 . . . . 0.0 110.759 178.119 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -59.19 -41.86 89.51 Favored 'General case' 0 C--O 1.219 -0.542 0 CA-C-O 117.906 -1.045 . . . . 0.0 110.37 175.654 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 38.0 t -62.39 -33.66 75.2 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 120.247 1.385 . . . . 0.0 112.467 176.781 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 77.8 m-20 -69.16 -43.9 73.37 Favored 'General case' 0 CA--C 1.542 0.666 0 N-CA-C 115.488 1.662 . . . . 0.0 115.488 173.402 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 65.7 t-105 -72.01 -31.62 66.39 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.606 1.562 . . . . 0.0 113.203 175.671 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 46.7 t-20 -76.32 -24.12 54.29 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 127.603 2.361 . . . . 0.0 111.893 172.085 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 81.2 mt-30 -80.8 -3.82 52.42 Favored 'General case' 0 CA--C 1.544 0.733 0 O-C-N 120.961 -1.087 . . . . 0.0 113.213 163.29 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 88.2 m-70 61.12 32.64 19.62 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 125.998 1.719 . . . . 0.0 113.755 171.769 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 74.3 mttt -70.03 160.48 31.89 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.711 1.604 . . . . 0.0 111.696 175.432 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 9.2 pm0 -56.29 111.59 1.01 Allowed 'General case' 0 CA--C 1.549 0.937 0 N-CA-C 113.383 0.882 . . . . 0.0 113.383 176.997 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 45.5 tp -57.54 -49.48 76.21 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 124.254 1.022 . . . . 0.0 112.872 -169.8 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 65.8 mm-40 -66.19 -16.51 64.05 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 113.828 1.047 . . . . 0.0 113.828 -174.378 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 18.3 tptm -97.34 -44.78 6.74 Favored 'General case' 0 N--CA 1.465 0.322 0 C-N-CA 125.249 1.42 . . . . 0.0 112.05 174.148 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 56.5 m -76.67 -17.09 59.33 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 114.927 1.454 . . . . 0.0 114.927 -177.153 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 7.9 ptt85 -63.33 160.12 16.61 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 123.807 0.843 . . . . 0.0 112.544 169.05 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -169.14 174.5 43.61 Favored Glycine 0 CA--C 1.526 0.775 0 CA-C-N 115.564 -0.744 . . . . 0.0 113.641 170.418 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 31.3 m -91.01 139.88 16.92 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.382 0 C-N-CA 124.706 1.203 . . . . 0.0 111.164 168.274 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 41.8 p90 -135.64 154.7 78.33 Favored Pre-proline 0 CA--C 1.539 0.55 0 C-N-CA 124.831 1.253 . . . . 0.0 112.152 174.808 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -68.38 114.44 3.46 Favored 'Trans proline' 0 CA--C 1.535 0.558 0 C-N-CA 122.103 1.869 . . . . 0.0 110.103 170.66 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 15.4 pt-20 -54.02 -30.63 48.35 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.835 0.854 . . . . 0.0 112.617 -179.22 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 7.3 p-10 -70.03 -18.08 63.28 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 127.041 2.137 . . . . 0.0 113.481 -177.432 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 19.6 m-85 -72.4 -11.08 60.53 Favored 'General case' 0 CA--C 1.536 0.409 0 N-CA-C 116.442 2.016 . . . . 0.0 116.442 163.507 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 589' ' ' THR . . . . . . . . . . . . . 34.2 p -125.29 178.42 5.6 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 126.331 1.852 . . . . 0.0 112.675 -175.902 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -131.43 140.1 49.54 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 125.458 1.503 . . . . 0.0 110.089 169.983 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -64.11 114.19 4.01 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 124.767 1.227 . . . . 0.0 109.855 171.68 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 592' ' ' VAL . . . . . 0.52 HG23 ' HB2' ' A' ' 524' ' ' LYS . 1.3 m -95.74 155.69 38.2 Favored Pre-proline 0 N--CA 1.478 0.952 0 C-N-CA 125.308 1.443 . . . . 0.0 108.977 176.99 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 593' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo . . . . . 0 C--O 1.253 1.236 0 C-N-CA 124.076 3.184 . . . . 0.0 113.103 -178.445 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B 1728 ' ' SER . . . . . . . . . . . . . 28.8 t . . . . . 0 N--CA 1.48 1.028 0 N-CA-C 112.632 0.605 . . . . 0.0 112.632 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B 1729 ' ' THR . . . . . . . . . . . . . 1.7 p -76.43 -11.14 59.84 Favored 'General case' 0 N--CA 1.48 1.051 0 N-CA-C 116.863 2.171 . . . . 0.0 116.863 -171.514 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B 1730 ' ' VAL . . . . . . . . . . . . . 4.5 m -53.49 150.31 12.87 Favored Pre-proline 0 N--CA 1.475 0.776 0 C-N-CA 125.614 1.565 . . . . 0.0 113.675 177.001 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -64.34 166.21 17.79 Favored 'Trans proline' 0 CA--C 1.54 0.799 0 C-N-CA 123.058 2.505 . . . . 0.0 112.95 176.624 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 3.5 t -134.62 131.71 54.09 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 C-N-CA 125.276 1.431 . . . . 0.0 112.443 -178.087 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -68.52 133.43 90.91 Favored Pre-proline 0 CA--C 1.548 0.897 0 O-C-N 121.443 -0.786 . . . . 0.0 111.491 -176.321 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -78.58 165.13 25.37 Favored 'Trans proline' 0 CA--C 1.548 1.186 0 C-N-CA 122.982 2.455 . . . . 0.0 113.088 -178.334 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -60.53 144.93 99.57 Favored 'Trans proline' 0 CA--C 1.539 0.735 0 C-N-CA 123.533 2.822 . . . . 0.0 114.028 179.263 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B 1736 ' ' ARG . . . . . . . . . . . . . 49.3 mtp180 -115.58 160.37 20.07 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 126.153 1.781 . . . . 0.0 111.27 174.742 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B 1737 ' ' ARG . . . . . . . . . . . . . 58.9 mtt180 -73.24 170.38 15.12 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 124.692 1.197 . . . . 0.0 112.969 176.117 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B 1738 ' ' ARG . . . . . . . . . . . . . 28.4 ptt-85 -125.69 38.51 4.15 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 127.049 2.14 . . . . 0.0 112.553 -174.007 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B 1739 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.28 169.58 2.1 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 127.083 2.153 . . . . 0.0 115.302 -170.125 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B 1740 ' ' GLY . . . . . . . . . . . . . . . 80.16 -39.86 2.3 Favored Glycine 0 CA--C 1.531 1.06 0 N-CA-C 116.827 1.491 . . . . 0.0 116.827 164.412 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B 1741 ' ' ARG . . . . . . . . . . . . . 74.6 mtm180 55.16 66.57 1.19 Allowed 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 125.623 1.569 . . . . 0.0 113.749 179.539 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B 1742 ' ' ASN . . . . . . . . . . . . . 3.8 m120 -74.45 158.28 34.13 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 124.923 1.289 . . . . 0.0 111.884 174.97 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B 1743 ' ' LEU . . . . . . . . . . . . . 82.9 mt -111.12 -11.84 14.22 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.332 1.453 . . . . 0.0 114.761 -178.433 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B 1744 ' ' THR . . . . . . . . . . . . . 3.4 t . . . . . 0 N--CA 1.483 1.215 0 N-CA-C 115.643 1.72 . . . . 0.0 115.643 -175.841 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 513' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.941 0 N-CA-C 111.568 -0.613 . . . . 0.0 111.568 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 514' ' ' ARG . . . . . . . . . . . . . 34.6 mmt180 -104.79 168.35 9.12 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 125.292 1.437 . . . . 0.0 112.47 172.622 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 96.4 mt -95.76 -39.18 9.99 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 124.201 1.0 . . . . 0.0 111.663 171.796 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 516' ' ' ASP . . . . . . . . . . . . . 23.6 t0 -79.63 139.16 37.53 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-O 123.157 1.456 . . . . 0.0 108.583 175.406 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 517' ' ' LEU . . . . . 0.477 HD22 HD22 ' A' ' 548' ' ' LEU . 13.4 mt -123.2 158.95 56.55 Favored Pre-proline 0 C--N 1.324 -0.523 0 C-N-CA 125.987 1.715 . . . . 0.0 110.526 -175.679 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_endo -65.01 160.95 39.04 Favored 'Trans proline' 0 CA--C 1.538 0.695 0 C-N-CA 122.846 2.364 . . . . 0.0 113.484 -173.253 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -58.17 135.4 68.09 Favored 'Trans proline' 0 N--CA 1.46 -0.5 0 C-N-CA 122.893 2.396 . . . . 0.0 110.541 176.911 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 69.9 0.77 28.58 Favored Glycine 0 CA--C 1.535 1.308 0 CA-C-O 117.357 -1.802 . . . . 0.0 115.893 -178.677 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 34.7 t80 -36.29 125.28 0.79 Allowed 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 121.057 2.428 . . . . 0.0 116.814 -178.538 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 63.0 mtm -98.92 -53.31 3.31 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 123.344 0.658 . . . . 0.0 112.344 -177.15 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 523' ' ' PHE . . . . . . . . . . . . . 26.8 p90 -164.39 169.14 17.75 Favored 'General case' 0 C--O 1.223 -0.318 0 C-N-CA 126.332 1.853 . . . . 0.0 112.834 -174.093 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 524' ' ' LYS . . . . . 0.562 ' HE2' ' CD2' ' A' ' 548' ' ' LEU . 87.9 mttt -100.83 163.12 12.46 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 122.219 1.009 . . . . 0.0 111.253 166.938 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 17.3 m -135.45 161.6 38.9 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 C-N-CA 126.248 1.819 . . . . 0.0 109.016 165.92 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 58.0 tt0 -124.54 130.02 51.68 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 118.39 0.541 . . . . 0.0 111.877 169.848 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 527' ' ' ALA . . . . . 0.417 ' HA ' HG22 ' A' ' 589' ' ' THR . . . -59.59 124.13 19.1 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.988 0.915 . . . . 0.0 111.95 177.341 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 75.6 mm-40 -87.94 -25.74 23.05 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.127 1.371 . . . . 0.0 112.298 173.769 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 59.0 m-70 -139.2 167.81 21.24 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 127.177 2.191 . . . . 0.0 109.221 178.522 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 10.6 p-10 -85.22 138.81 32.11 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 125.071 1.348 . . . . 0.0 114.512 174.609 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 89.7 t80 -133.12 107.55 8.28 Favored 'General case' 0 C--O 1.235 0.299 0 C-N-CA 125.09 1.356 . . . . 0.0 111.803 179.198 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 532' ' ' THR . . . . . . . . . . . . 0.251 0.6 OUTLIER -81.61 104.55 12.1 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 113.697 0.999 . . . . 0.0 113.697 170.884 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -59.7 133.05 55.74 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 125.337 1.455 . . . . 0.0 110.895 176.986 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 4.4 t -109.1 -10.48 15.0 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.618 1.567 . . . . 0.0 115.047 -171.935 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 12.3 m-20 -133.45 153.36 51.68 Favored 'General case' 0 N--CA 1.463 0.209 0 C-N-CA 126.38 1.872 . . . . 0.0 115.745 176.929 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 536' ' ' THR . . . . . . . . . . . . 0.252 1.3 t -62.43 -27.42 69.1 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 116.582 2.067 . . . . 0.0 116.582 -171.301 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 87.2 m-20 -72.54 -17.49 61.72 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 116.407 2.002 . . . . 0.0 116.407 171.13 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 82.6 mt-10 -82.27 149.78 27.63 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.383 1.473 . . . . 0.0 114.243 -177.343 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -97.89 128.71 44.66 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 126.638 1.975 . . . . 0.0 110.422 177.651 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 15.3 tt0 -86.15 127.81 34.78 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 123.613 0.765 . . . . 0.0 111.549 178.495 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 76.9 mt -122.43 143.97 49.34 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 124.7 1.2 . . . . 0.0 112.295 -178.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 6.6 tmtm? -115.78 147.42 40.99 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 126.23 1.812 . . . . 0.0 109.329 169.717 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -54.12 120.49 6.52 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-O 121.993 0.901 . . . . 0.0 110.888 -179.613 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 100.47 0.79 55.56 Favored Glycine 0 CA--C 1.529 0.917 0 C-N-CA 125.381 1.467 . . . . 0.0 114.756 -178.481 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 80.8 m-20 -70.86 122.59 20.21 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 119.303 1.552 . . . . 0.0 113.77 -179.516 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 58.7 t -69.9 133.99 30.9 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.614 0 N-CA-C 109.198 -0.668 . . . . 0.0 109.198 166.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -126.69 124.16 64.47 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.503 0 C-N-CA 124.794 1.238 . . . . 0.0 111.41 171.757 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 548' ' ' LEU . . . . . 0.562 ' CD2' ' HE2' ' A' ' 524' ' ' LYS . 20.0 mt -80.13 100.07 8.06 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.547 1.139 . . . . 0.0 108.477 175.621 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 549' ' ' VAL . . . . . . . . . . . . . 4.1 t -63.51 132.0 29.23 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.224 0 N-CA-C 114.688 1.366 . . . . 0.0 114.688 173.837 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 17.0 pt -128.12 155.65 77.68 Favored Pre-proline 0 CA--C 1.544 0.739 0 C-N-CA 126.54 1.936 . . . . 0.0 110.435 179.186 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -70.52 152.77 65.6 Favored 'Trans proline' 0 N--CA 1.459 -0.53 0 C-N-CA 123.548 2.832 . . . . 0.0 110.619 171.329 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 52.2 m-85 -69.86 140.47 53.22 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 115.792 1.775 . . . . 0.0 115.792 -176.706 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 553' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -66.32 -14.4 61.98 Favored 'General case' 0 CA--C 1.542 0.673 0 N-CA-C 115.352 1.612 . . . . 0.0 115.352 173.846 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 4.0 m-20 -161.09 154.48 18.19 Favored Pre-proline 0 CA--C 1.543 0.701 0 C-N-CA 126.007 1.723 . . . . 0.0 111.105 171.061 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 555' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_endo -67.99 -34.59 22.72 Favored 'Trans proline' 0 CA--C 1.542 0.881 0 C-N-CA 123.398 2.732 . . . . 0.0 112.058 175.002 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -66.72 -24.13 66.2 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 113.665 0.987 . . . . 0.0 113.665 172.541 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 557' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -73.62 -19.12 60.95 Favored 'General case' 0 CA--C 1.542 0.644 0 O-C-N 120.546 -1.346 . . . . 0.0 113.469 175.312 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 40.1 tt0 -83.73 143.21 30.17 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 125.362 1.465 . . . . 0.0 113.669 -179.527 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 25.7 m-20 -127.43 149.65 49.99 Favored 'General case' 0 CA--C 1.553 1.079 0 C-N-CA 125.411 1.485 . . . . 0.0 110.8 -178.141 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -70.77 120.25 16.09 Favored 'General case' 0 N--CA 1.477 0.905 0 O-C-N 120.637 -1.289 . . . . 0.0 112.813 -170.331 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 83.68 -0.11 89.67 Favored Glycine 0 CA--C 1.54 1.636 0 C-N-CA 124.422 1.01 . . . . 0.0 115.275 -173.754 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 53.8 m95 -90.34 164.71 14.23 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 125.285 1.434 . . . . 0.0 113.437 176.102 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 11.4 mt -134.06 161.23 35.43 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 125.256 1.422 . . . . 0.0 110.517 165.657 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 55.8 ttm -116.01 145.91 42.58 Favored 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 124.853 1.261 . . . . 0.0 112.018 171.59 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -172.56 -169.44 35.2 Favored Glycine 0 CA--C 1.525 0.673 0 C-N-CA 124.402 1.001 . . . . 0.0 112.434 178.073 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 14.7 p -136.6 141.57 40.62 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 C-N-CA 125.731 1.612 . . . . 0.0 109.461 173.636 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 37.1 mtmt -58.07 135.22 56.96 Favored 'General case' 0 N--CA 1.469 0.518 0 O-C-N 121.138 -0.976 . . . . 0.0 110.788 174.967 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 19.5 tt0 -60.76 -39.0 87.16 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 119.636 -0.826 . . . . 0.0 110.186 174.273 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 47.3 t -58.09 -37.36 74.36 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 124.293 1.037 . . . . 0.0 112.427 177.15 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 -74.19 -44.28 54.01 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 114.959 1.466 . . . . 0.0 114.959 175.861 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 60.3 t-105 -67.67 -32.29 72.86 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.589 1.156 . . . . 0.0 112.975 176.562 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 26.7 t-20 -66.48 -35.66 80.83 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 126.414 1.886 . . . . 0.0 112.278 174.221 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 75.5 mt-30 -75.9 -5.7 47.36 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 125.566 1.546 . . . . 0.0 113.649 175.241 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 95.8 m-70 56.43 48.16 17.44 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 125.136 1.374 . . . . 0.0 112.66 -178.123 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 26.9 mttp -75.76 162.25 28.35 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 124.961 1.305 . . . . 0.0 111.778 166.533 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 14.1 pm0 -63.88 103.14 0.54 Allowed 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.379 1.072 . . . . 0.0 112.747 177.761 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 32.4 tp -58.31 -35.56 72.05 Favored 'General case' 0 CA--C 1.537 0.449 0 O-C-N 121.212 -0.93 . . . . 0.0 111.903 -174.515 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -65.08 -16.06 63.05 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 124.59 1.156 . . . . 0.0 113.885 -179.17 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 32.1 mmtp -114.28 -39.98 3.76 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 125.585 1.554 . . . . 0.0 112.442 177.623 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 39.1 m -70.51 -24.83 62.9 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 114.221 1.193 . . . . 0.0 114.221 177.063 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 17.3 ptp180 -62.01 160.97 11.46 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-N 118.91 0.777 . . . . 0.0 111.777 169.104 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -173.49 172.44 45.2 Favored Glycine 0 CA--C 1.521 0.468 0 CA-C-N 115.401 -0.818 . . . . 0.0 114.078 175.823 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 31.9 m -89.35 139.19 17.83 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.387 0 C-N-CA 124.282 1.033 . . . . 0.0 111.374 169.738 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 40.7 p90 -133.6 154.8 80.88 Favored Pre-proline 0 CA--C 1.541 0.628 0 C-N-CA 124.62 1.168 . . . . 0.0 112.889 173.381 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -65.61 110.75 1.7 Allowed 'Trans proline' 0 C--N 1.346 0.436 0 C-N-CA 122.039 1.826 . . . . 0.0 109.275 168.658 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 17.5 pt-20 -57.51 -26.93 62.07 Favored 'General case' 0 N--CA 1.474 0.744 0 O-C-N 121.506 -0.746 . . . . 0.0 112.32 -176.799 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 13.3 p-10 -71.51 -12.45 61.38 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 127.063 2.145 . . . . 0.0 114.64 178.278 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 18.4 m-85 -74.31 -13.74 60.8 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 116.862 2.171 . . . . 0.0 116.862 163.731 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 589' ' ' THR . . . . . 0.417 HG22 ' HA ' ' A' ' 527' ' ' ALA . 58.7 p -122.63 173.21 7.86 Favored 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 125.671 1.588 . . . . 0.0 111.893 -174.222 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -127.72 136.41 51.5 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 123.916 0.887 . . . . 0.0 109.691 171.731 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -64.33 120.09 11.55 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 125.567 1.547 . . . . 0.0 109.221 178.579 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 592' ' ' VAL . . . . . 0.524 HG23 ' HB2' ' A' ' 524' ' ' LYS . 2.3 m -102.39 148.16 35.04 Favored Pre-proline 0 N--CA 1.476 0.86 0 C-N-CA 124.944 1.298 . . . . 0.0 108.329 177.539 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 593' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo . . . . . 0 C--O 1.254 1.287 0 C-N-CA 124.493 3.462 . . . . 0.0 114.649 -165.014 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B 1728 ' ' SER . . . . . . . . . . . . . 10.8 t . . . . . 0 N--CA 1.477 0.898 0 N-CA-C 109.6 -0.518 . . . . 0.0 109.6 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B 1729 ' ' THR . . . . . . . . . . . . 0.463 0.6 OUTLIER 65.52 11.79 7.69 Favored 'General case' 0 N--CA 1.481 1.109 0 N-CA-C 117.874 2.546 . . . . 0.0 117.874 178.537 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B 1730 ' ' VAL . . . . . . . . . . . . . 19.2 m -136.66 151.74 73.23 Favored Pre-proline 0 N--CA 1.479 0.979 0 C-N-CA 125.754 1.622 . . . . 0.0 113.172 -177.321 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 88.9 Cg_endo -73.62 163.81 36.47 Favored 'Trans proline' 0 CA--C 1.539 0.771 0 C-N-CA 124.294 3.329 . . . . 0.0 112.612 169.908 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 4.0 p -140.26 147.35 23.49 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 C-N-CA 125.958 1.703 . . . . 0.0 109.301 170.948 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -72.34 141.55 83.42 Favored Pre-proline 0 CA--C 1.554 1.101 0 N-CA-C 113.401 0.889 . . . . 0.0 113.401 -173.641 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -79.12 168.54 20.34 Favored 'Trans proline' 0 CA--C 1.552 1.396 0 C-N-CA 123.451 2.767 . . . . 0.0 113.378 178.061 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 35.9 Cg_exo -63.98 157.72 51.38 Favored 'Trans proline' 0 CA--C 1.539 0.729 0 C-N-CA 124.217 3.278 . . . . 0.0 114.19 -179.694 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B 1736 ' ' ARG . . . . . . . . . . . . . 28.8 mtm180 -135.17 158.11 45.21 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 125.33 1.452 . . . . 0.0 112.176 -160.769 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B 1737 ' ' ARG . . . . . . . . . . . . . 36.5 mmt180 -145.13 87.17 1.8 Allowed 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 125.886 1.674 . . . . 0.0 112.569 -172.633 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B 1738 ' ' ARG . . . . . . . . . . . . . 7.7 mmp_? -62.51 146.48 51.59 Favored 'General case' 0 N--CA 1.481 1.115 0 O-C-N 121.035 -1.041 . . . . 0.0 111.817 175.031 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B 1739 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.89 171.65 4.24 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 125.323 1.449 . . . . 0.0 113.936 -167.423 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B 1740 ' ' GLY . . . . . . . . . . . . . . . 100.09 159.76 28.37 Favored Glycine 0 CA--C 1.537 1.43 0 C-N-CA 124.942 1.258 . . . . 0.0 113.43 -170.343 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B 1741 ' ' ARG . . . . . . . . . . . . . 12.7 mmp_? -75.07 -13.15 60.46 Favored 'General case' 0 N--CA 1.482 1.136 0 N-CA-C 115.898 1.814 . . . . 0.0 115.898 -165.422 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B 1742 ' ' ASN . . . . . . . . . . . . . 93.2 m-20 -100.5 126.03 46.88 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 124.363 1.065 . . . . 0.0 111.935 168.51 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B 1743 ' ' LEU . . . . . . . . . . . . . 10.8 mp -105.09 126.87 52.55 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 125.537 1.535 . . . . 0.0 109.876 170.822 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B 1744 ' ' THR . . . . . . . . . . . . . 6.8 p . . . . . 0 C--O 1.251 1.16 0 C-N-CA 126.581 1.952 . . . . 0.0 114.098 175.978 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 513' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.91 0 N-CA-C 111.137 -0.785 . . . . 0.0 111.137 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 514' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -77.7 172.94 12.64 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 125.397 1.479 . . . . 0.0 113.618 174.229 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 71.9 mt -85.76 -39.43 17.16 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.51 1.524 . . . . 0.0 112.5 172.915 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 516' ' ' ASP . . . . . . . . . . . . . 42.4 t0 -159.09 171.47 19.91 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 126.529 1.931 . . . . 0.0 108.306 -173.845 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 517' ' ' LEU . . . . . 0.422 HD22 HD22 ' A' ' 548' ' ' LEU . 10.3 mt -83.56 162.55 52.94 Favored Pre-proline 0 CA--C 1.55 0.973 0 C-N-CA 124.999 1.32 . . . . 0.0 111.249 164.304 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -66.43 161.51 40.66 Favored 'Trans proline' 0 CA--C 1.538 0.709 0 C-N-CA 123.477 2.785 . . . . 0.0 114.287 -173.759 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -61.19 128.53 25.41 Favored 'Trans proline' 0 N--CA 1.459 -0.519 0 C-N-CA 123.244 2.63 . . . . 0.0 111.098 -179.4 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 73.03 6.84 69.22 Favored Glycine 0 CA--C 1.534 1.257 0 CA-C-O 117.453 -1.748 . . . . 0.0 116.238 -178.116 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 35.1 t80 -37.88 135.68 0.63 Allowed 'General case' 0 CA--C 1.547 0.865 0 CA-C-N 120.852 2.326 . . . . 0.0 117.134 -179.997 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 60.8 mtm -109.26 -51.5 2.87 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.448 0.699 . . . . 0.0 112.832 -179.099 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 523' ' ' PHE . . . . . . . . . . . . . 23.7 p90 -165.54 167.41 17.45 Favored 'General case' 0 C--O 1.223 -0.314 0 C-N-CA 125.984 1.713 . . . . 0.0 114.018 -174.018 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 524' ' ' LYS . . . . . 0.581 ' HB2' HG23 ' A' ' 592' ' ' VAL . 69.6 mttt -99.7 164.05 12.22 Favored 'General case' 0 N--CA 1.47 0.535 0 O-C-N 121.389 -0.819 . . . . 0.0 111.664 166.312 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 17.8 m -139.45 156.12 26.38 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.975 0 C-N-CA 126.952 2.101 . . . . 0.0 109.007 167.685 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 63.8 tt0 -119.01 128.88 54.79 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 119.157 0.889 . . . . 0.0 112.007 170.912 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 527' ' ' ALA . . . . . 0.459 ' HA ' HG22 ' A' ' 589' ' ' THR . . . -60.26 117.82 5.65 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.708 1.203 . . . . 0.0 111.726 176.434 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 65.4 mm-40 -81.44 -26.36 35.4 Favored 'General case' 0 CA--C 1.537 0.442 0 C-N-CA 124.741 1.217 . . . . 0.0 111.076 170.58 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 81.3 m-70 -138.11 164.27 29.55 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 125.36 1.464 . . . . 0.0 112.476 -175.441 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . 0.253 1.7 p30 -77.41 132.33 38.45 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 115.015 1.487 . . . . 0.0 115.015 176.305 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 79.2 t80 -137.82 122.1 18.17 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 113.728 1.011 . . . . 0.0 113.728 176.707 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -87.44 125.14 34.11 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 114.665 1.357 . . . . 0.0 114.665 175.071 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -66.56 129.7 40.71 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-O 121.122 0.486 . . . . 0.0 110.851 169.561 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 4.6 p -97.9 -36.02 10.3 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 126.496 1.918 . . . . 0.0 113.777 171.436 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 96.4 m-20 -95.09 156.44 16.32 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 125.262 1.425 . . . . 0.0 114.642 176.197 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 7.7 t -54.99 -29.48 57.25 Favored 'General case' 0 N--CA 1.472 0.625 0 N-CA-C 114.665 1.357 . . . . 0.0 114.665 164.822 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 90.8 m-20 -104.97 6.13 33.26 Favored 'General case' 0 CA--C 1.544 0.726 0 N-CA-C 115.353 1.612 . . . . 0.0 115.353 175.867 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 57.3 mt-10 -86.19 152.11 23.09 Favored 'General case' 0 CA--C 1.541 0.621 0 O-C-N 120.392 -1.443 . . . . 0.0 111.103 165.0 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -101.87 132.92 47.37 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.92 1.288 . . . . 0.0 111.201 -176.294 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 29.1 tt0 -82.91 127.93 33.97 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 123.999 0.919 . . . . 0.0 109.941 174.354 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 85.0 mt -130.34 139.98 50.65 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 125.234 1.413 . . . . 0.0 111.696 -179.248 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 3.7 tmtt? -110.07 145.93 36.24 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 125.716 1.607 . . . . 0.0 110.048 168.085 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -54.54 96.06 0.01 OUTLIER 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 124.527 1.131 . . . . 0.0 112.085 173.113 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 134.01 -10.71 4.8 Favored Glycine 0 CA--C 1.536 1.377 0 C-N-CA 126.948 2.213 . . . . 0.0 114.717 -175.72 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 79.8 m-20 -77.88 127.35 32.25 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 114.962 1.467 . . . . 0.0 114.962 -170.272 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 1.9 t -77.27 135.94 25.45 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.827 0 N-CA-C 113.235 0.828 . . . . 0.0 113.235 167.899 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 1.4 t -124.59 121.91 62.55 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.358 0 C-N-CA 125.97 1.708 . . . . 0.0 110.996 175.843 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 548' ' ' LEU . . . . . 0.447 HD23 ' HG2' ' A' ' 524' ' ' LYS . 18.4 mt -77.22 101.98 6.45 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 108.212 -1.033 . . . . 0.0 108.212 172.202 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 549' ' ' VAL . . . . . . . . . . . . . 7.5 t -64.25 133.58 29.71 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.23 0 N-CA-C 114.548 1.314 . . . . 0.0 114.548 173.694 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 14.9 pt -130.2 159.27 71.2 Favored Pre-proline 0 CA--C 1.544 0.735 0 C-N-CA 126.728 2.011 . . . . 0.0 109.595 -178.348 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -71.1 141.72 40.47 Favored 'Trans proline' 0 C--O 1.24 0.62 0 C-N-CA 123.16 2.573 . . . . 0.0 111.83 175.848 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 45.4 m-85 -56.71 143.2 37.35 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 115.179 1.548 . . . . 0.0 115.179 166.455 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 553' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -59.45 -24.52 63.62 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 113.873 1.064 . . . . 0.0 113.873 175.188 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -161.83 152.28 14.54 Favored Pre-proline 0 CA--C 1.546 0.826 0 C-N-CA 124.855 1.262 . . . . 0.0 112.825 176.465 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 555' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -72.7 -25.17 17.54 Favored 'Trans proline' 0 CA--C 1.539 0.741 0 C-N-CA 124.195 3.263 . . . . 0.0 113.777 -177.644 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 21.7 pt-20 -70.16 -30.74 67.96 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.83 0.852 . . . . 0.0 112.36 169.34 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 557' ' ' GLU . . . . . . . . . . . . . 71.4 mm-40 -76.42 -29.21 56.95 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 124.725 1.21 . . . . 0.0 112.772 179.154 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 40.7 tt0 -66.24 120.92 14.09 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 124.604 1.162 . . . . 0.0 112.503 177.756 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 53.6 m-20 -85.31 142.3 29.44 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.884 1.274 . . . . 0.0 112.529 171.987 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 52.6 tp10 -78.36 131.81 37.14 Favored 'General case' 0 N--CA 1.469 0.512 0 O-C-N 120.292 -1.505 . . . . 0.0 111.368 -170.36 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 80.61 -4.05 71.0 Favored Glycine 0 CA--C 1.537 1.442 0 O-C-N 121.636 -0.665 . . . . 0.0 114.37 -173.133 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 47.5 m95 -89.75 165.27 14.27 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.21 1.404 . . . . 0.0 112.654 172.721 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 14.4 mt -134.87 154.82 51.5 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 125.545 1.538 . . . . 0.0 110.004 167.663 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 35.8 tpp -110.68 142.24 42.85 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 125.188 1.395 . . . . 0.0 110.863 171.651 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -165.07 -174.62 34.96 Favored Glycine 0 CA--C 1.526 0.744 0 O-C-N 121.336 -0.852 . . . . 0.0 113.561 174.922 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 13.0 p -130.62 139.71 50.58 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 C-N-CA 125.026 1.33 . . . . 0.0 108.8 169.341 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 36.3 mtmt -57.07 137.05 56.29 Favored 'General case' 0 N--CA 1.467 0.375 0 O-C-N 121.4 -0.813 . . . . 0.0 111.36 176.205 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 47.5 tt0 -60.96 -38.9 87.52 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-O 118.411 -0.804 . . . . 0.0 111.126 178.44 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 61.8 m -68.96 -31.91 71.12 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 119.504 1.047 . . . . 0.0 113.495 175.934 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 -65.57 -42.71 91.49 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 122.473 1.13 . . . . 0.0 113.924 170.057 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 46.9 t-105 -78.05 -27.58 48.75 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.668 1.187 . . . . 0.0 113.832 178.803 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 5.3 t-20 -67.04 -34.05 76.86 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 119.724 1.147 . . . . 0.0 110.98 173.922 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 39.3 mt-30 -73.83 -11.0 60.24 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 113.909 1.077 . . . . 0.0 113.909 165.492 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 68.7 m-70 56.68 38.44 29.54 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.434 1.494 . . . . 0.0 113.339 -178.252 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 62.5 mttt -60.82 162.82 6.31 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 125.221 1.409 . . . . 0.0 112.52 172.051 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -48.49 95.41 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 126.947 2.099 . . . . 0.0 113.867 174.786 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 49.9 tp -52.85 -47.8 67.52 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 125.801 1.64 . . . . 0.0 111.933 -169.744 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -63.33 -20.7 65.73 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 125.333 1.453 . . . . 0.0 114.601 -175.166 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 32.7 mmtp -102.73 -43.35 5.6 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.288 1.035 . . . . 0.0 111.756 176.218 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 62.1 m -63.22 -30.94 71.99 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 113.907 1.077 . . . . 0.0 113.907 176.48 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 2.7 ptt85 -62.57 166.1 5.65 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-O 122.32 1.057 . . . . 0.0 113.151 175.498 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -177.94 171.0 43.48 Favored Glycine 0 CA--C 1.524 0.646 0 CA-C-N 114.22 -1.355 . . . . 0.0 113.275 170.975 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 31.7 m -87.44 145.27 7.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 C-N-CA 124.983 1.313 . . . . 0.0 110.394 171.098 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 44.2 p90 -141.23 155.37 68.06 Favored Pre-proline 0 C--O 1.24 0.579 0 C-N-CA 124.115 0.966 . . . . 0.0 113.285 175.652 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -66.82 108.56 1.49 Allowed 'Trans proline' 0 N--CA 1.458 -0.561 0 C-N-CA 122.245 1.963 . . . . 0.0 109.489 169.515 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 17.7 pt-20 -55.5 -27.64 49.82 Favored 'General case' 0 N--CA 1.475 0.776 0 O-C-N 121.457 -0.777 . . . . 0.0 112.588 -177.533 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 11.5 p-10 -67.13 -21.66 65.82 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 125.967 1.707 . . . . 0.0 113.872 178.177 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 13.4 m-85 -68.53 -15.35 63.51 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 116.412 2.004 . . . . 0.0 116.412 166.407 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 589' ' ' THR . . . . . 0.459 HG22 ' HA ' ' A' ' 527' ' ' ALA . 62.7 p -120.62 174.85 6.31 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 126.065 1.746 . . . . 0.0 111.18 -177.473 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -135.64 139.77 44.02 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.886 0.874 . . . . 0.0 109.802 171.986 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -61.13 134.2 56.8 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 126.851 2.06 . . . . 0.0 112.157 -177.573 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 592' ' ' VAL . . . . . 0.581 HG23 ' HB2' ' A' ' 524' ' ' LYS . 3.5 m -130.86 149.43 73.65 Favored Pre-proline 0 CA--C 1.546 0.806 0 C-N-CA 124.169 0.988 . . . . 0.0 109.854 177.295 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 593' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo . . . . . 0 C--O 1.254 1.276 1 C-N-CA 125.395 4.064 . . . . 0.0 113.106 -177.472 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B 1728 ' ' SER . . . . . . . . . . . . . 47.2 t . . . . . 0 N--CA 1.475 0.784 0 CA-C-O 120.851 0.358 . . . . 0.0 110.992 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B 1729 ' ' THR . . . . . . . . . . . . 0.265 0.2 OUTLIER -101.76 -11.45 19.1 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 116.558 2.058 . . . . 0.0 116.558 -171.538 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B 1730 ' ' VAL . . . . . . . . . . . . . 2.9 m -73.58 139.72 78.07 Favored Pre-proline 0 N--CA 1.472 0.662 0 C-N-CA 124.019 0.928 . . . . 0.0 112.243 165.848 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 78.9 Cg_endo -74.83 166.32 29.54 Favored 'Trans proline' 0 CA--C 1.539 0.754 0 C-N-CA 123.675 2.916 . . . . 0.0 113.616 -179.136 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 47.0 t -136.28 134.62 49.95 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.94 0 C-N-CA 126.294 1.837 . . . . 0.0 109.643 178.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -67.52 142.56 96.37 Favored Pre-proline 0 CA--C 1.551 0.991 0 N-CA-C 112.882 0.697 . . . . 0.0 112.882 -173.551 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -73.71 162.13 40.3 Favored 'Trans proline' 0 CA--C 1.539 0.731 0 C-N-CA 122.762 2.308 . . . . 0.0 111.861 176.385 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -63.67 164.14 22.19 Favored 'Trans proline' 0 CA--C 1.539 0.76 0 C-N-CA 122.812 2.341 . . . . 0.0 112.179 178.676 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B 1736 ' ' ARG . . . . . . . . . . . . . 79.2 mtp180 -123.51 151.57 42.66 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 126.06 1.744 . . . . 0.0 109.688 177.98 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B 1737 ' ' ARG . . . . . . . . . . . . . 25.0 mmm180 -73.5 176.95 5.65 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 126.08 1.752 . . . . 0.0 113.406 -160.406 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B 1738 ' ' ARG . . . . . . . . . . . . . 75.1 mtt180 -61.3 -34.93 76.03 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 124.143 0.977 . . . . 0.0 113.202 172.538 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B 1739 ' ' ARG . . . . . . . . . . . . . 33.9 ttt85 -70.85 128.49 36.18 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 123.56 0.744 . . . . 0.0 111.554 169.103 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B 1740 ' ' GLY . . . . . . . . . . . . . . . 149.79 -173.76 29.45 Favored Glycine 0 CA--C 1.534 1.246 0 C-N-CA 125.0 1.286 . . . . 0.0 112.173 -171.54 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B 1741 ' ' ARG . . . . . . . . . . . . . 20.2 ttp85 -82.87 -0.01 46.21 Favored 'General case' 0 N--CA 1.484 1.263 0 N-CA-C 114.014 1.116 . . . . 0.0 114.014 -178.251 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B 1742 ' ' ASN . . . . . . . . . . . . . 9.5 p-10 -57.59 139.44 53.54 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.056 1.342 . . . . 0.0 112.136 169.839 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B 1743 ' ' LEU . . . . . . . . . . . . . 1.7 pt? -86.33 140.2 30.27 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 123.884 0.874 . . . . 0.0 112.218 177.313 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B 1744 ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.485 1.309 0 N-CA-C 116.518 2.044 . . . . 0.0 116.518 179.964 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 513' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.379 0 N-CA-C 112.138 -0.385 . . . . 0.0 112.138 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 514' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -66.28 157.64 31.07 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 125.122 1.369 . . . . 0.0 114.258 178.592 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -79.37 -29.88 42.34 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.535 1.534 . . . . 0.0 112.619 166.798 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 516' ' ' ASP . . . . . . . . . . . . . 18.5 p30 -123.75 153.91 40.24 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 115.53 1.678 . . . . 0.0 115.53 -178.963 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 10.0 mt -121.61 160.52 46.05 Favored Pre-proline 0 CA--C 1.544 0.718 0 C-N-CA 125.79 1.636 . . . . 0.0 112.343 -174.004 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -66.91 160.39 47.2 Favored 'Trans proline' 0 CA--C 1.538 0.695 0 C-N-CA 123.755 2.97 . . . . 0.0 113.581 -173.774 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -63.99 135.67 48.84 Favored 'Trans proline' 0 N--CA 1.456 -0.732 0 C-N-CA 123.135 2.557 . . . . 0.0 109.787 178.997 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 70.6 1.57 38.29 Favored Glycine 0 CA--C 1.535 1.314 0 CA-C-O 116.693 -2.17 . . . . 0.0 116.306 -176.299 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 30.5 t80 -35.61 135.84 0.26 Allowed 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 117.573 2.434 . . . . 0.0 117.573 -178.631 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 44.9 mtm -103.99 -64.64 1.08 Allowed 'General case' 0 C--O 1.237 0.406 0 C-N-CA 123.271 0.628 . . . . 0.0 111.595 179.872 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 523' ' ' PHE . . . . . 0.437 ' CE2' HG21 ' A' ' 549' ' ' VAL . 41.6 p90 -158.78 174.55 14.85 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 124.781 1.232 . . . . 0.0 112.881 -175.39 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 524' ' ' LYS . . . . . 0.539 ' HE2' ' CD2' ' A' ' 548' ' ' LEU . 78.8 mttt -108.0 160.93 15.4 Favored 'General case' 0 N--CA 1.472 0.661 0 O-C-N 121.173 -0.954 . . . . 0.0 112.593 173.524 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 16.7 m -136.5 159.7 37.86 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 C-N-CA 126.698 1.999 . . . . 0.0 109.926 167.385 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 60.7 tt0 -122.55 130.88 53.5 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 124.031 0.932 . . . . 0.0 112.591 169.749 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 527' ' ' ALA . . . . . 0.424 ' HA ' HG22 ' A' ' 589' ' ' THR . . . -63.44 121.42 13.78 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.753 1.221 . . . . 0.0 112.613 178.289 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 60.6 mm-40 -84.32 -22.75 30.53 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.345 1.458 . . . . 0.0 111.986 172.974 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 97.7 m-70 -142.72 161.88 36.93 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 126.418 1.887 . . . . 0.0 111.135 -168.672 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -87.8 123.39 32.54 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.981 1.712 . . . . 0.0 115.344 -179.729 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 78.2 t80 -130.56 113.45 14.25 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 124.33 1.052 . . . . 0.0 112.148 -176.241 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 1.2 m -89.33 127.07 35.76 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 124.636 1.175 . . . . 0.0 114.075 169.561 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -74.13 132.12 41.95 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-O 122.545 1.165 . . . . 0.0 112.778 -173.912 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 534' ' ' THR . . . . . . . . . . . . 0.289 3.3 t -108.97 14.88 23.82 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 126.214 1.806 . . . . 0.0 114.624 -177.928 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 24.9 t0 -150.7 159.34 44.58 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.86 1.264 . . . . 0.0 108.074 175.837 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 1.4 t -72.54 -10.43 59.78 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 115.01 1.485 . . . . 0.0 115.01 167.45 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 95.4 m-20 -76.64 -25.24 53.6 Favored 'General case' 0 N--CA 1.47 0.547 0 N-CA-C 116.379 1.992 . . . . 0.0 116.379 162.968 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 70.6 mt-10 -87.17 153.64 21.35 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 114.229 1.196 . . . . 0.0 114.229 -166.598 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -100.04 129.35 46.08 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 126.91 2.084 . . . . 0.0 110.051 176.549 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 18.4 tt0 -80.43 130.27 35.05 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.474 0.709 . . . . 0.0 110.198 173.183 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 78.2 mt -124.58 146.64 48.93 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 124.771 1.229 . . . . 0.0 111.067 176.721 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -116.77 149.21 40.3 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 124.474 1.11 . . . . 0.0 109.403 167.071 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -54.29 105.91 0.17 Allowed 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 123.233 0.613 . . . . 0.0 111.753 176.097 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 121.31 -8.64 10.32 Favored Glycine 0 CA--C 1.534 1.25 0 C-N-CA 126.678 2.085 . . . . 0.0 114.1 -177.826 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 84.6 m-20 -78.91 123.91 27.73 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 119.414 1.607 . . . . 0.0 114.757 -172.679 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 2.4 t -73.17 138.8 20.62 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 C-N-CA 123.74 0.816 . . . . 0.0 112.049 171.816 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -129.13 124.69 61.11 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.41 0 C-N-CA 125.192 1.397 . . . . 0.0 111.594 176.567 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 548' ' ' LEU . . . . . 0.539 ' CD2' ' HE2' ' A' ' 524' ' ' LYS . 17.3 mt -81.23 98.27 8.02 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.568 1.147 . . . . 0.0 108.134 176.252 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 549' ' ' VAL . . . . . 0.437 HG21 ' CE2' ' A' ' 523' ' ' PHE . 3.0 t -57.74 125.05 13.12 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.111 0 N-CA-C 113.548 0.944 . . . . 0.0 113.548 169.579 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 6.0 pt -122.76 157.53 59.51 Favored Pre-proline 0 N--CA 1.473 0.722 0 C-N-CA 126.641 1.976 . . . . 0.0 108.981 178.437 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -63.83 149.62 90.29 Favored 'Trans proline' 0 N--CA 1.461 -0.41 0 C-N-CA 122.635 2.223 . . . . 0.0 110.272 173.863 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 552' ' ' PHE . . . . . 0.426 ' CE1' ' HA ' ' A' ' 558' ' ' GLN . 29.3 m-85 -66.1 137.48 57.08 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 116.188 1.921 . . . . 0.0 116.188 179.699 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 553' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -67.09 -21.36 65.87 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 115.191 1.552 . . . . 0.0 115.191 -176.172 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 6.4 m-20 -160.09 154.59 20.4 Favored Pre-proline 0 CA--C 1.547 0.832 0 C-N-CA 125.384 1.474 . . . . 0.0 110.881 177.392 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 555' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -69.95 -29.66 22.63 Favored 'Trans proline' 0 CA--C 1.538 0.699 0 C-N-CA 123.938 3.092 . . . . 0.0 112.891 178.127 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 3.1 pt-20 -72.04 -16.32 62.04 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 113.395 0.887 . . . . 0.0 113.395 170.627 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 557' ' ' GLU . . . . . . . . . . . . . 53.2 mm-40 -90.0 -15.51 31.74 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 124.91 1.284 . . . . 0.0 113.965 -178.591 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 558' ' ' GLN . . . . . 0.426 ' HA ' ' CE1' ' A' ' 552' ' ' PHE . 40.6 tt0 -89.07 132.14 34.91 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 125.471 1.508 . . . . 0.0 113.782 -179.49 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -125.93 144.26 50.76 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 125.005 1.322 . . . . 0.0 108.665 -170.954 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -77.64 129.9 36.16 Favored 'General case' 0 N--CA 1.475 0.782 0 O-C-N 120.205 -1.559 . . . . 0.0 112.666 -171.35 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 81.41 -0.42 87.84 Favored Glycine 0 CA--C 1.539 1.543 0 C-N-CA 124.37 0.986 . . . . 0.0 114.703 -172.967 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 54.0 m95 -102.59 162.69 12.73 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 126.789 2.036 . . . . 0.0 112.508 175.14 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 11.1 mt -138.74 154.86 48.57 Favored 'General case' 0 N--CA 1.472 0.655 0 O-C-N 121.146 -0.971 . . . . 0.0 110.894 172.864 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 48.3 ttm -112.79 139.88 48.04 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 124.983 1.313 . . . . 0.0 111.718 -179.164 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -170.08 -174.77 38.52 Favored Glycine 0 CA--C 1.522 0.528 0 C-N-CA 124.292 0.948 . . . . 0.0 112.732 178.264 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 13.8 p -128.24 140.29 49.6 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.493 0 C-N-CA 125.48 1.512 . . . . 0.0 109.118 170.416 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 36.3 mtmt -59.89 136.17 57.92 Favored 'General case' 0 N--CA 1.465 0.317 0 O-C-N 121.459 -0.775 . . . . 0.0 111.056 176.694 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -57.94 -40.55 80.78 Favored 'General case' 0 C--O 1.22 -0.453 0 CA-C-O 118.096 -0.954 . . . . 0.0 110.558 176.927 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 52.3 m -59.32 -44.05 92.63 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 119.903 1.228 . . . . 0.0 113.017 175.11 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -62.64 -35.2 78.85 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 115.336 1.606 . . . . 0.0 115.336 173.465 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 69.6 t-105 -79.54 -31.86 42.13 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.63 1.172 . . . . 0.0 113.332 175.476 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 21.8 t-20 -71.69 -30.23 65.45 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 126.332 1.853 . . . . 0.0 111.845 177.913 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 50.6 mt-30 -83.11 3.49 30.45 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 114.022 1.119 . . . . 0.0 114.022 171.127 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 55.3 m-70 57.93 30.18 18.74 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 126.316 1.846 . . . . 0.0 114.148 178.963 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 45.5 mttt -68.01 161.54 26.41 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 124.838 1.255 . . . . 0.0 111.351 174.296 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 20.0 pt-20 -56.4 105.92 0.24 Allowed 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 124.654 1.181 . . . . 0.0 114.122 -177.64 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 42.5 tp -54.39 -48.86 71.06 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 125.094 1.357 . . . . 0.0 112.14 -173.827 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 21.1 pm0 -59.05 -18.83 38.39 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 126.301 1.84 . . . . 0.0 114.974 -177.508 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 66.7 mmtt -124.74 -8.68 7.31 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 115.606 1.706 . . . . 0.0 115.606 177.403 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 97.9 m -80.16 -32.34 38.82 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 123.984 0.914 . . . . 0.0 112.27 163.422 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 36.4 ptt180 -61.61 157.12 18.17 Favored 'General case' 0 N--CA 1.474 0.733 0 O-C-N 121.378 -0.826 . . . . 0.0 112.724 174.944 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -170.2 174.86 44.3 Favored Glycine 0 CA--C 1.524 0.634 0 C-N-CA 124.643 1.116 . . . . 0.0 113.139 174.996 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 21.5 m -93.77 142.67 12.96 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 C-N-CA 124.553 1.141 . . . . 0.0 111.682 169.427 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 38.9 p90 -136.18 154.48 77.36 Favored Pre-proline 0 CA--C 1.539 0.525 0 C-N-CA 125.057 1.343 . . . . 0.0 112.863 176.699 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -66.21 112.85 2.43 Favored 'Trans proline' 0 N--CA 1.457 -0.65 0 C-N-CA 121.62 1.547 . . . . 0.0 108.845 169.57 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 22.1 pt-20 -52.73 -33.35 47.62 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 123.265 0.626 . . . . 0.0 111.821 -179.37 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 9.8 p-10 -69.99 -10.84 60.01 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 127.473 2.309 . . . . 0.0 114.636 -178.637 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 16.5 m-85 -77.24 -11.68 59.86 Favored 'General case' 0 N--CA 1.468 0.466 0 N-CA-C 116.82 2.155 . . . . 0.0 116.82 162.199 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 589' ' ' THR . . . . . 0.424 HG22 ' HA ' ' A' ' 527' ' ' ALA . 67.8 p -129.82 170.47 13.84 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 125.992 1.717 . . . . 0.0 111.779 -174.272 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -131.36 137.49 48.76 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 124.162 0.985 . . . . 0.0 110.74 175.985 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 12.9 tpt180 -56.98 135.12 56.21 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 126.366 1.866 . . . . 0.0 112.023 177.388 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 592' ' ' VAL . . . . . 0.52 HG23 ' HB2' ' A' ' 524' ' ' LYS . 2.1 m -130.29 153.55 81.27 Favored Pre-proline 0 N--CA 1.481 1.084 0 C-N-CA 125.975 1.71 . . . . 0.0 109.304 176.13 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 593' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo . . . . . 0 C--O 1.251 1.166 0 C-N-CA 124.364 3.376 . . . . 0.0 115.479 -167.462 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B 1728 ' ' SER . . . . . . . . . . . . . 45.6 m . . . . . 0 N--CA 1.479 0.986 0 N-CA-C 112.209 0.448 . . . . 0.0 112.209 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B 1729 ' ' THR . . . . . . . . . . . . 0.439 0.6 OUTLIER 57.11 36.38 27.51 Favored 'General case' 0 N--CA 1.482 1.133 0 N-CA-C 116.375 1.991 . . . . 0.0 116.375 177.158 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B 1730 ' ' VAL . . . . . . . . . . . . . 1.5 m -77.61 145.68 71.76 Favored Pre-proline 0 N--CA 1.474 0.744 0 N-CA-C 114.72 1.378 . . . . 0.0 114.72 -173.685 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -69.68 168.25 22.0 Favored 'Trans proline' 0 CA--C 1.539 0.761 0 C-N-CA 124.003 3.135 . . . . 0.0 114.459 179.522 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 65.6 t -129.86 133.82 64.07 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.842 0 C-N-CA 126.268 1.827 . . . . 0.0 109.709 177.379 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -68.51 132.22 91.29 Favored Pre-proline 0 CA--C 1.549 0.912 0 O-C-N 121.651 -0.655 . . . . 0.0 111.887 179.764 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -75.78 167.0 27.19 Favored 'Trans proline' 0 CA--C 1.544 0.979 0 C-N-CA 122.134 1.889 . . . . 0.0 112.019 -177.503 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 73.8 Cg_exo -50.4 151.85 9.35 Favored 'Trans proline' 0 C--N 1.347 0.5 0 C-N-CA 124.012 3.141 . . . . 0.0 112.654 169.931 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B 1736 ' ' ARG . . . . . . . . . . . . . 1.2 ptm180 -162.73 129.52 3.56 Favored 'General case' 0 N--CA 1.466 0.355 0 C-N-CA 124.227 1.011 . . . . 0.0 112.221 172.274 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B 1737 ' ' ARG . . . . . . . . . . . . . 2.3 ptm180 -47.82 155.67 0.39 Allowed 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 127.192 2.197 . . . . 0.0 113.298 166.891 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B 1738 ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -132.65 151.62 51.91 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 124.959 1.303 . . . . 0.0 112.577 -176.206 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B 1739 ' ' ARG . . . . . . . . . . . . . 2.4 mpp_? -90.14 149.25 22.53 Favored 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 115.257 1.577 . . . . 0.0 115.257 -161.039 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B 1740 ' ' GLY . . . . . . . . . . . . . . . -86.65 -160.63 34.9 Favored Glycine 0 CA--C 1.535 1.304 0 C-N-CA 125.06 1.315 . . . . 0.0 112.963 167.207 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B 1741 ' ' ARG . . . . . . . . . . . . . 12.0 mmp_? -59.83 120.79 10.25 Favored 'General case' 0 N--CA 1.479 0.992 0 O-C-N 121.54 -0.976 . . . . 0.0 111.417 174.276 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B 1742 ' ' ASN . . . . . . . . . . . . . 4.8 m-20 -84.45 93.26 8.26 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.363 0.665 . . . . 0.0 110.366 171.031 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B 1743 ' ' LEU . . . . . . . . . . . . . 56.3 tp -64.95 106.94 1.35 Allowed 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 124.183 0.993 . . . . 0.0 110.442 179.858 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B 1744 ' ' THR . . . . . . . . . . . . 0.279 1.4 m . . . . . 0 C--O 1.251 1.172 0 C-N-CA 125.847 1.659 . . . . 0.0 114.029 -171.109 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 513' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 1.007 0 N-CA-C 110.917 -0.873 . . . . 0.0 110.917 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 514' ' ' ARG . . . . . . . . . . . . . 4.9 mmp_? -84.89 161.01 20.02 Favored 'General case' 0 N--CA 1.483 1.219 0 N-CA-C 114.64 1.348 . . . . 0.0 114.64 -174.787 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 64.7 tp -98.81 -42.75 7.05 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.724 1.61 . . . . 0.0 111.691 169.019 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 516' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -74.79 136.08 41.68 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 124.595 1.158 . . . . 0.0 113.997 174.515 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 517' ' ' LEU . . . . . 0.482 HD22 HD22 ' A' ' 548' ' ' LEU . 10.4 mt -128.0 155.77 77.24 Favored Pre-proline 0 CA--C 1.537 0.475 0 C-N-CA 125.585 1.554 . . . . 0.0 112.445 -169.617 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -65.52 158.22 54.17 Favored 'Trans proline' 0 CA--C 1.537 0.674 0 C-N-CA 123.882 3.055 . . . . 0.0 113.756 -169.482 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -62.2 133.42 43.61 Favored 'Trans proline' 0 N--CA 1.456 -0.733 0 C-N-CA 123.306 2.671 . . . . 0.0 109.809 177.705 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 75.13 3.17 68.52 Favored Glycine 0 CA--C 1.534 1.247 0 CA-C-O 117.73 -1.594 . . . . 0.0 115.432 -175.347 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 37.2 t80 -42.6 125.55 3.34 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 121.024 2.412 . . . . 0.0 116.21 178.951 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 60.5 mtm -97.06 -47.76 5.66 Favored 'General case' 0 N--CA 1.471 0.575 0 C-N-CA 123.782 0.833 . . . . 0.0 112.546 -177.195 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 523' ' ' PHE . . . . . 0.442 ' CE1' HG21 ' A' ' 549' ' ' VAL . 23.8 p90 -171.15 167.19 7.15 Favored 'General case' 0 C--O 1.223 -0.321 0 C-N-CA 128.177 2.591 . . . . 0.0 112.504 -176.404 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 524' ' ' LYS . . . . . 0.562 ' HG2' HD23 ' A' ' 548' ' ' LEU . 85.1 mttt -96.9 160.71 14.2 Favored 'General case' 0 N--CA 1.47 0.539 0 O-C-N 120.871 -1.143 . . . . 0.0 111.653 165.365 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 16.4 m -133.09 161.36 41.69 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 C-N-CA 125.334 1.453 . . . . 0.0 109.959 163.18 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 43.8 tt0 -128.33 128.92 45.49 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 124.009 0.923 . . . . 0.0 111.875 174.841 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 527' ' ' ALA . . . . . 0.545 ' HA ' HG22 ' A' ' 589' ' ' THR . . . -62.83 123.52 18.69 Favored 'General case' 0 CA--C 1.538 0.484 0 O-C-N 121.547 -0.721 . . . . 0.0 111.576 -178.584 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 42.3 mm-40 -87.24 -32.96 19.48 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 124.785 1.234 . . . . 0.0 110.044 168.888 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 97.6 m-70 -130.54 153.66 48.62 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 126.54 1.936 . . . . 0.0 110.798 179.039 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -79.42 141.6 36.69 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 125.276 1.43 . . . . 0.0 113.182 176.566 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 86.4 t80 -134.0 128.2 33.88 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 115.397 1.629 . . . . 0.0 115.397 -174.974 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -92.9 112.13 23.98 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 116.268 1.951 . . . . 0.0 116.268 177.983 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -67.7 130.69 43.78 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 123.835 0.854 . . . . 0.0 111.026 171.81 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 534' ' ' THR . . . . . . . . . . . . 0.259 12.1 t -136.39 31.23 2.89 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 125.946 1.698 . . . . 0.0 112.694 179.739 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 41.1 t0 -146.66 169.99 17.87 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 125.086 1.354 . . . . 0.0 109.056 167.364 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 1.1 t -67.6 -26.77 66.43 Favored 'General case' 0 N--CA 1.47 0.536 0 N-CA-C 115.871 1.804 . . . . 0.0 115.871 168.048 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 35.6 t0 -76.51 -27.71 56.13 Favored 'General case' 0 CA--C 1.547 0.852 0 O-C-N 121.069 -1.02 . . . . 0.0 110.887 178.363 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 60.3 mt-10 -80.76 149.29 29.71 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 115.404 1.631 . . . . 0.0 115.404 -164.596 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -101.62 137.88 39.35 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 128.967 2.907 . . . . 0.0 109.866 174.506 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 19.9 tt0 -95.47 134.95 37.73 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 123.994 0.917 . . . . 0.0 111.064 175.892 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 80.1 mt -125.68 148.1 49.13 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.388 1.075 . . . . 0.0 112.647 -178.189 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 3.1 tppp? -113.57 141.31 47.33 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 126.85 2.06 . . . . 0.0 109.497 164.491 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -52.47 114.02 1.24 Allowed 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 119.025 0.829 . . . . 0.0 110.982 173.575 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 115.61 -15.41 17.18 Favored Glycine 0 CA--C 1.529 0.936 0 C-N-CA 126.024 1.773 . . . . 0.0 113.463 -173.161 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 78.3 m-20 -66.83 118.63 10.61 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 118.953 1.377 . . . . 0.0 113.873 -178.037 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 45.9 t -72.53 134.75 29.22 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 166.791 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -127.49 123.08 60.82 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.386 0 C-N-CA 125.856 1.662 . . . . 0.0 111.184 175.86 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 548' ' ' LEU . . . . . 0.562 HD23 ' HG2' ' A' ' 524' ' ' LYS . 22.3 mt -81.39 98.84 8.39 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.894 1.278 . . . . 0.0 108.393 178.438 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 549' ' ' VAL . . . . . 0.442 HG21 ' CE1' ' A' ' 523' ' ' PHE . 3.4 t -62.43 131.97 27.98 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.236 0 N-CA-C 114.772 1.397 . . . . 0.0 114.772 175.812 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 18.2 pt -133.24 158.24 76.23 Favored Pre-proline 0 CA--C 1.551 1.011 0 C-N-CA 127.134 2.173 . . . . 0.0 109.935 177.859 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 82.8 Cg_endo -71.16 154.51 62.01 Favored 'Trans proline' 0 CA--C 1.537 0.626 0 C-N-CA 124.031 3.154 . . . . 0.0 112.016 174.639 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 24.5 m-85 -67.18 159.58 28.71 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 116.747 2.129 . . . . 0.0 116.747 -174.728 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 553' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -65.75 -24.7 67.01 Favored 'General case' 0 N--CA 1.476 0.827 0 O-C-N 121.127 -0.983 . . . . 0.0 113.222 172.584 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 53.5 m-20 -157.99 150.76 18.15 Favored Pre-proline 0 CA--C 1.544 0.712 0 C-N-CA 126.421 1.888 . . . . 0.0 111.538 177.977 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 555' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -66.46 -35.45 30.4 Favored 'Trans proline' 0 CA--C 1.539 0.772 0 C-N-CA 123.107 2.538 . . . . 0.0 111.406 168.39 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 23.8 pt-20 -71.08 -9.12 57.51 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.423 1.489 . . . . 0.0 114.108 172.306 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 557' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 -97.07 -25.63 15.28 Favored 'General case' 0 N--CA 1.478 0.942 0 O-C-N 121.123 -0.986 . . . . 0.0 113.561 166.961 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 42.7 tt0 -65.53 118.72 9.87 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 124.023 0.929 . . . . 0.0 113.053 -177.448 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 50.6 m-20 -90.84 128.65 36.81 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 126.012 1.725 . . . . 0.0 110.886 -179.246 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 6.0 tm-20 -65.04 135.1 55.19 Favored 'General case' 0 N--CA 1.475 0.814 0 O-C-N 120.358 -1.464 . . . . 0.0 111.608 -178.701 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 80.51 -5.72 63.42 Favored Glycine 0 CA--C 1.538 1.524 0 C-N-CA 124.25 0.928 . . . . 0.0 115.229 -174.651 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 48.0 m95 -93.95 167.15 11.79 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 125.199 1.4 . . . . 0.0 112.87 172.846 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 16.8 mt -134.36 160.15 38.83 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 124.49 1.116 . . . . 0.0 110.328 165.177 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 38.1 ttm -114.77 143.45 45.06 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 124.976 1.31 . . . . 0.0 111.307 175.503 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -170.58 -172.5 36.99 Favored Glycine 0 CA--C 1.523 0.586 0 CA-C-O 121.687 0.604 . . . . 0.0 113.304 176.288 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 14.5 p -132.54 136.91 55.29 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 C-N-CA 125.595 1.558 . . . . 0.0 109.214 173.226 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 40.4 mtmt -62.86 137.85 58.38 Favored 'General case' 0 N--CA 1.465 0.318 0 O-C-N 121.085 -1.009 . . . . 0.0 111.805 178.758 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 71.2 tt0 -58.04 -44.89 87.64 Favored 'General case' 0 C--O 1.222 -0.356 0 CA-C-O 118.268 -0.872 . . . . 0.0 110.866 -178.15 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 10.5 t -63.92 -26.5 68.62 Favored 'General case' 0 CA--C 1.546 0.79 0 CA-C-N 119.735 1.152 . . . . 0.0 112.983 -177.427 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -72.84 -48.23 39.49 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 126.69 1.996 . . . . 0.0 109.452 175.951 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 64.6 t-105 -67.64 -30.3 69.82 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.443 1.497 . . . . 0.0 113.003 176.154 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 33.8 t-20 -76.17 -25.68 55.48 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 127.009 2.124 . . . . 0.0 112.202 175.869 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 32.0 mt-30 -80.1 3.22 21.12 Favored 'General case' 0 CA--C 1.546 0.797 0 N-CA-C 113.375 0.88 . . . . 0.0 113.375 160.351 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 95.0 m-70 54.38 34.43 20.73 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 126.241 1.816 . . . . 0.0 114.491 175.697 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 5.6 mtpm? -75.05 158.17 33.61 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 125.289 1.436 . . . . 0.0 111.758 178.092 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 8.1 pm0 -53.18 108.83 0.36 Allowed 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.738 1.615 . . . . 0.0 114.37 -176.707 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 64.0 tp -57.0 -47.29 81.19 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 125.197 1.399 . . . . 0.0 112.945 -170.041 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 56.6 mt-10 -68.13 -24.07 64.97 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 114.488 1.292 . . . . 0.0 114.488 -174.852 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 43.1 mmtm -85.52 -47.05 10.27 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 123.618 0.767 . . . . 0.0 111.816 168.692 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 89.5 m -67.45 -28.53 67.96 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 114.381 1.252 . . . . 0.0 114.381 -172.13 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 36.2 ptt180 -64.63 163.27 14.07 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 124.635 1.174 . . . . 0.0 113.505 175.428 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -171.63 172.9 44.85 Favored Glycine 0 CA--C 1.531 1.057 0 C-N-CA 125.092 1.33 . . . . 0.0 114.27 174.449 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 14.7 m -91.67 143.97 10.2 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.61 0 C-N-CA 125.522 1.529 . . . . 0.0 112.639 170.847 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 49.3 p90 -142.25 155.59 64.69 Favored Pre-proline 0 CA--C 1.545 0.778 0 C-N-CA 124.876 1.27 . . . . 0.0 112.91 176.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_endo -69.08 110.3 2.38 Favored 'Trans proline' 0 C--N 1.348 0.548 0 C-N-CA 122.453 2.102 . . . . 0.0 109.973 171.651 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -57.3 -25.1 58.76 Favored 'General case' 0 N--CA 1.474 0.761 0 O-C-N 121.311 -0.868 . . . . 0.0 113.273 -179.364 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 8.7 p-10 -70.24 -9.51 56.1 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.33 1.452 . . . . 0.0 114.464 176.726 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 18.6 m-85 -80.22 -12.64 59.61 Favored 'General case' 0 CA--C 1.539 0.539 0 N-CA-C 116.668 2.099 . . . . 0.0 116.668 164.949 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 589' ' ' THR . . . . . 0.545 HG22 ' HA ' ' A' ' 527' ' ' ALA . 39.4 p -127.26 176.87 7.08 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 125.543 1.537 . . . . 0.0 110.591 -170.727 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 16.7 pt-20 -134.67 147.98 50.25 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 124.96 1.304 . . . . 0.0 110.747 173.085 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 2.7 tmm_? -60.21 136.85 58.15 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 124.631 1.173 . . . . 0.0 112.812 173.054 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 592' ' ' VAL . . . . . 0.476 HG23 ' CB ' ' A' ' 524' ' ' LYS . 1.1 m -139.76 154.84 71.33 Favored Pre-proline 0 CA--C 1.549 0.909 0 C-N-CA 126.752 2.021 . . . . 0.0 109.302 177.099 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 593' ' ' PRO . . . . . . . . . . . . . 81.6 Cg_endo . . . . . 0 C--O 1.251 1.158 1 C-N-CA 125.433 4.089 . . . . 0.0 113.788 -178.652 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B 1728 ' ' SER . . . . . . . . . . . . . 44.8 t . . . . . 0 N--CA 1.475 0.823 0 CA-C-O 120.548 0.213 . . . . 0.0 110.772 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B 1729 ' ' THR . . . . . . . . . . . . 0.43 0.7 OUTLIER 69.97 9.35 7.07 Favored 'General case' 0 N--CA 1.482 1.129 0 N-CA-C 118.139 2.644 . . . . 0.0 118.139 173.283 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B 1730 ' ' VAL . . . . . . . . . . . . . 28.8 m -65.8 149.4 97.51 Favored Pre-proline 0 N--CA 1.478 0.935 0 C-N-CA 125.168 1.387 . . . . 0.0 112.39 179.371 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -65.66 174.98 4.79 Favored 'Trans proline' 0 CA--C 1.544 0.988 0 C-N-CA 124.541 3.494 . . . . 0.0 114.065 178.921 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 7.7 p -139.82 136.27 38.98 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 C-N-CA 125.3 1.44 . . . . 0.0 111.815 179.634 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -70.24 141.76 89.09 Favored Pre-proline 0 CA--C 1.553 1.081 0 O-C-N 121.496 -0.752 . . . . 0.0 112.915 -176.276 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -74.37 163.88 35.3 Favored 'Trans proline' 0 CA--C 1.543 0.93 0 C-N-CA 122.804 2.336 . . . . 0.0 111.947 174.329 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -65.57 148.43 87.4 Favored 'Trans proline' 0 CA--C 1.541 0.862 0 C-N-CA 122.581 2.187 . . . . 0.0 112.116 179.396 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B 1736 ' ' ARG . . . . . . . . . . . . . 31.4 mtp-105 -107.15 144.92 33.18 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 124.809 1.244 . . . . 0.0 112.159 169.828 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B 1737 ' ' ARG . . . . . . . . . . . . . 9.3 mmt85 -103.64 159.69 15.39 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 124.926 1.29 . . . . 0.0 113.761 -151.66 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B 1738 ' ' ARG . . . . . . . . . . . . . 31.3 tpt85 -63.08 -39.42 94.66 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 125.19 1.396 . . . . 0.0 113.17 -175.539 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B 1739 ' ' ARG . . . . . . . . . . . . . 9.5 mtt85 -170.65 101.21 0.24 Allowed 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 128.851 2.86 . . . . 0.0 109.293 152.37 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B 1740 ' ' GLY . . . . . . . . . . . . . . . 57.19 -139.57 46.2 Favored Glycine 0 CA--C 1.535 1.297 0 C-N-CA 124.305 0.955 . . . . 0.0 114.325 175.364 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B 1741 ' ' ARG . . . . . . . . . . . . . 14.2 mmm180 -108.52 7.46 26.82 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 124.808 1.243 . . . . 0.0 113.828 177.007 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B 1742 ' ' ASN . . . . . . . . . . . . . 47.9 t30 -77.54 73.85 4.1 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 125.239 1.415 . . . . 0.0 111.498 178.397 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B 1743 ' ' LEU . . . . . . . . . . . . . 51.4 mt -72.75 -20.33 61.21 Favored 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 114.623 1.342 . . . . 0.0 114.623 -170.304 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B 1744 ' ' THR . . . . . . . . . . . . 0.325 0.6 OUTLIER . . . . . 0 C--O 1.251 1.141 0 N-CA-C 117.56 2.429 . . . . 0.0 117.56 -176.487 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 513' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 1.088 0 N-CA-C 111.843 -0.503 . . . . 0.0 111.843 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 514' ' ' ARG . . . . . . . . . . . . . 11.8 mmt180 -69.02 -43.23 75.19 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 125.218 1.407 . . . . 0.0 114.164 -174.694 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 44.0 mt 65.36 -15.75 0.1 Allowed 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 128.78 2.832 . . . . 0.0 115.401 -158.287 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 516' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -77.77 157.36 30.04 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.206 1.402 . . . . 0.0 113.908 174.331 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 517' ' ' LEU . . . . . 0.472 HD22 HD22 ' A' ' 548' ' ' LEU . 18.0 mt -136.21 160.97 64.99 Favored Pre-proline 0 CA--C 1.547 0.832 0 C-N-CA 125.719 1.608 . . . . 0.0 113.731 -160.626 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 34.8 Cg_endo -67.3 161.07 44.72 Favored 'Trans proline' 0 CA--C 1.54 0.805 0 C-N-CA 124.296 3.331 . . . . 0.0 114.298 -173.72 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -63.87 128.26 21.54 Favored 'Trans proline' 0 C--N 1.35 0.616 0 C-N-CA 123.065 2.51 . . . . 0.0 110.414 -178.623 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 75.34 3.9 72.26 Favored Glycine 0 CA--C 1.534 1.221 0 CA-C-O 117.425 -1.764 . . . . 0.0 115.367 -177.246 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 31.7 t80 -36.17 132.19 0.56 Allowed 'General case' 0 CA--C 1.545 0.763 0 N-CA-C 117.387 2.366 . . . . 0.0 117.387 177.168 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 38.0 mtm -100.06 -56.55 2.34 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 123.848 0.859 . . . . 0.0 112.437 -177.195 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 523' ' ' PHE . . . . . . . . . . . . . 28.6 p90 -167.06 168.18 13.93 Favored 'General case' 0 C--O 1.225 -0.229 0 C-N-CA 127.44 2.296 . . . . 0.0 112.245 -172.279 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 524' ' ' LYS . . . . . 0.547 ' HB2' HG23 ' A' ' 592' ' ' VAL . 82.2 mttt -103.1 163.61 12.12 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 121.135 -0.978 . . . . 0.0 111.356 171.331 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 12.0 m -134.26 160.5 41.62 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.813 0 C-N-CA 126.889 2.076 . . . . 0.0 109.331 165.268 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 48.0 tt0 -124.06 128.26 49.07 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-N 119.618 1.099 . . . . 0.0 112.324 170.236 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 527' ' ' ALA . . . . . 0.479 ' HA ' HG22 ' A' ' 589' ' ' THR . . . -60.62 123.91 18.83 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 124.401 1.081 . . . . 0.0 111.105 178.049 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 76.5 mm-40 -85.39 -37.6 19.68 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 125.448 1.499 . . . . 0.0 111.104 171.103 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 81.3 m-70 -127.63 155.59 43.65 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 127.025 2.13 . . . . 0.0 109.438 176.624 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -82.19 151.29 26.96 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 107.41 -1.33 . . . . 0.0 107.41 178.387 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 94.1 t80 -137.88 113.82 9.89 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 125.099 1.36 . . . . 0.0 113.288 -178.609 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 2.0 m -86.36 118.89 26.09 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 124.405 1.082 . . . . 0.0 113.45 172.696 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -70.22 146.58 50.6 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 124.896 1.278 . . . . 0.0 113.077 -179.864 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 14.5 t -102.01 -31.78 10.48 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 125.314 1.446 . . . . 0.0 113.381 171.111 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 87.2 m-20 -108.08 155.32 20.52 Favored 'General case' 0 N--CA 1.47 0.544 0 N-CA-C 116.808 2.151 . . . . 0.0 116.808 -172.389 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 4.3 t -65.91 -13.3 59.43 Favored 'General case' 0 N--CA 1.483 1.198 0 N-CA-C 116.51 2.041 . . . . 0.0 116.51 -178.547 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . 0.298 63.6 m-20 -113.75 2.53 15.21 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 117.114 2.265 . . . . 0.0 117.114 167.6 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 53.0 mt-10 -74.22 142.84 45.34 Favored 'General case' 0 CA--C 1.541 0.619 0 O-C-N 120.253 -1.53 . . . . 0.0 111.412 167.09 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -89.62 130.98 35.84 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 126.133 1.773 . . . . 0.0 109.643 176.21 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 14.7 tt0 -85.19 131.25 34.46 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 121.677 -0.639 . . . . 0.0 111.422 173.054 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 75.0 mt -121.11 151.1 40.26 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 124.423 1.089 . . . . 0.0 112.631 179.004 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 6.8 tmtt? -116.85 140.57 49.29 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 126.322 1.849 . . . . 0.0 109.753 169.496 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -53.9 106.6 0.2 Allowed 'General case' 0 CA--C 1.548 0.875 0 CA-C-N 119.12 0.873 . . . . 0.0 110.968 175.515 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 114.63 -6.84 22.44 Favored Glycine 0 CA--C 1.538 1.48 0 C-N-CA 125.518 1.533 . . . . 0.0 114.743 -172.943 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -65.5 118.97 10.22 Favored 'General case' 0 CA--C 1.519 -0.227 0 CA-C-N 119.503 1.651 . . . . 0.0 113.723 174.613 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 2.8 t -70.63 134.52 29.9 Favored 'Isoleucine or valine' 0 C--O 1.236 0.352 0 C-N-CA 120.656 -0.418 . . . . 0.0 110.252 159.208 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 1.1 t -123.32 124.47 69.94 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 C-N-CA 125.612 1.565 . . . . 0.0 110.93 175.388 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 548' ' ' LEU . . . . . 0.472 HD22 HD22 ' A' ' 517' ' ' LEU . 22.2 mt -83.75 99.15 10.08 Favored 'General case' 0 C--N 1.324 -0.541 0 C-N-CA 124.56 1.144 . . . . 0.0 108.216 179.293 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 549' ' ' VAL . . . . . . . . . . . . . 4.1 t -61.57 129.56 24.66 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.109 0 N-CA-C 114.052 1.131 . . . . 0.0 114.052 174.545 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 10.5 pt -124.18 153.73 68.38 Favored Pre-proline 0 CA--C 1.548 0.874 0 C-N-CA 126.44 1.896 . . . . 0.0 110.723 178.233 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -71.17 135.46 27.17 Favored 'Trans proline' 0 CA--C 1.534 0.508 0 C-N-CA 123.91 3.074 . . . . 0.0 111.296 178.56 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 552' ' ' PHE . . . . . 0.443 ' CE1' ' HA ' ' A' ' 558' ' ' GLN . 23.9 m-85 -59.64 138.14 57.82 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 117.664 2.468 . . . . 0.0 117.664 -174.963 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 553' ' ' GLN . . . . . . . . . . . . . 23.6 pt20 -69.67 -24.09 63.56 Favored 'General case' 0 CA--C 1.544 0.726 0 N-CA-C 114.411 1.263 . . . . 0.0 114.411 179.092 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 31.9 m-20 -145.23 149.31 41.09 Favored Pre-proline 0 CA--C 1.543 0.69 0 C-N-CA 125.962 1.705 . . . . 0.0 111.893 178.626 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 555' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_endo -67.85 -39.31 11.57 Favored 'Trans proline' 0 CA--C 1.539 0.753 0 C-N-CA 123.64 2.893 . . . . 0.0 112.68 179.003 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 22.5 pt-20 -70.32 -19.61 63.06 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 124.61 1.164 . . . . 0.0 113.817 176.717 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 557' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -78.32 -21.84 49.01 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 113.462 0.912 . . . . 0.0 113.462 177.098 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 558' ' ' GLN . . . . . 0.443 ' HA ' ' CE1' ' A' ' 552' ' ' PHE . 40.0 tp60 -64.72 146.6 54.54 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 122.154 0.978 . . . . 0.0 111.853 165.534 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . 0.256 6.6 m-20 -141.16 150.66 43.05 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 126.485 1.914 . . . . 0.0 114.525 174.661 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 51.3 tp10 -75.23 127.5 33.33 Favored 'General case' 0 N--CA 1.472 0.64 0 O-C-N 121.013 -1.054 . . . . 0.0 111.06 -173.492 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 82.18 -7.26 64.33 Favored Glycine 0 CA--C 1.538 1.518 0 C-N-CA 124.484 1.04 . . . . 0.0 114.255 -168.874 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 60.8 m95 -98.41 155.57 17.17 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.851 1.261 . . . . 0.0 112.897 178.927 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 6.8 mt -143.55 152.49 41.5 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 125.201 1.401 . . . . 0.0 110.493 176.475 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 55.7 ttm -110.45 140.28 44.85 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 124.275 1.03 . . . . 0.0 112.359 -179.587 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -172.69 -171.69 37.71 Favored Glycine 0 CA--C 1.524 0.641 0 C-N-CA 123.92 0.772 . . . . 0.0 113.237 -179.284 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 11.6 p -131.87 143.2 40.94 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.53 0 C-N-CA 125.131 1.372 . . . . 0.0 110.506 172.375 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 42.0 mtmt -57.94 131.49 50.58 Favored 'General case' 0 N--CA 1.467 0.397 0 O-C-N 121.615 -0.678 . . . . 0.0 111.704 175.08 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -62.49 -40.59 97.19 Favored 'General case' 0 C--O 1.223 -0.325 0 CA-C-O 118.281 -0.866 . . . . 0.0 110.548 176.543 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 26.6 t -58.74 -32.33 69.13 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 119.559 1.072 . . . . 0.0 112.291 177.003 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -76.77 -45.72 27.94 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 114.98 1.474 . . . . 0.0 114.98 177.038 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 56.2 t-105 -67.28 -39.15 85.97 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.85 1.26 . . . . 0.0 112.957 176.492 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 5.0 t-20 -64.17 -28.71 69.94 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 124.894 1.278 . . . . 0.0 111.201 176.061 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 39.4 mt-30 -92.0 7.17 43.42 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.429 1.492 . . . . 0.0 114.614 171.991 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 89.0 m-70 56.48 34.74 24.83 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 126.432 1.893 . . . . 0.0 114.449 176.508 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 62.2 mttt -73.78 155.77 38.51 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.452 1.101 . . . . 0.0 111.614 174.553 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 12.8 pm0 -57.03 102.93 0.09 Allowed 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 115.403 1.631 . . . . 0.0 115.403 -170.413 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 47.5 tp -53.0 -45.91 68.09 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 125.097 1.359 . . . . 0.0 112.165 -176.697 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 19.5 pt-20 -63.21 -16.14 59.24 Favored 'General case' 0 N--CA 1.479 0.999 0 N-CA-C 115.202 1.556 . . . . 0.0 115.202 -176.889 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 29.0 tptp -114.57 -37.0 4.4 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 125.927 1.691 . . . . 0.0 112.345 -178.987 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 47.9 t -70.23 -30.57 67.67 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.217 1.407 . . . . 0.0 112.885 176.965 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 30.9 ptt85 -60.58 158.64 12.0 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 124.174 0.989 . . . . 0.0 112.839 176.701 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -179.25 175.91 47.47 Favored Glycine 0 N--CA 1.461 0.337 0 CA-C-N 115.966 -0.561 . . . . 0.0 114.375 173.111 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 34.7 m -88.52 140.19 16.19 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 C-N-CA 124.317 1.047 . . . . 0.0 111.149 167.719 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 43.3 p90 -134.44 155.25 79.88 Favored Pre-proline 0 CA--C 1.538 0.503 0 C-N-CA 125.159 1.383 . . . . 0.0 112.565 173.552 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -66.31 113.58 2.72 Favored 'Trans proline' 0 CA--C 1.536 0.617 0 C-N-CA 122.427 2.085 . . . . 0.0 110.451 171.307 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 15.6 pt-20 -60.28 -26.09 66.22 Favored 'General case' 0 N--CA 1.475 0.786 0 O-C-N 121.108 -0.995 . . . . 0.0 112.03 -178.01 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 13.8 p-10 -71.37 -9.21 57.78 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 126.99 2.116 . . . . 0.0 114.444 177.005 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 14.0 m-85 -81.16 -14.09 57.98 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 116.714 2.116 . . . . 0.0 116.714 163.446 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 589' ' ' THR . . . . . 0.479 HG22 ' HA ' ' A' ' 527' ' ' ALA . 54.7 p -126.61 168.85 13.75 Favored 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 125.106 1.362 . . . . 0.0 110.453 -172.766 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -120.66 141.65 50.18 Favored 'General case' 0 N--CA 1.465 0.289 0 C-N-CA 123.489 0.716 . . . . 0.0 109.857 173.912 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.06 130.13 42.24 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 124.412 1.085 . . . . 0.0 109.157 174.732 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 592' ' ' VAL . . . . . 0.547 HG23 ' HB2' ' A' ' 524' ' ' LYS . 4.7 m -121.6 159.2 51.63 Favored Pre-proline 0 N--CA 1.477 0.92 0 C-N-CA 125.186 1.394 . . . . 0.0 108.938 179.446 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 593' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo . . . . . 0 C--O 1.252 1.202 0 C-N-CA 123.968 3.112 . . . . 0.0 114.66 -174.468 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B 1728 ' ' SER . . . . . . . . . . . . . 95.5 p . . . . . 0 N--CA 1.47 0.569 0 CA-C-O 120.444 0.164 . . . . 0.0 110.982 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B 1729 ' ' THR . . . . . . . . . . . . 0.42 1.1 p 63.41 12.43 6.31 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 117.324 2.342 . . . . 0.0 117.324 174.032 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B 1730 ' ' VAL . . . . . . . . . . . . . 3.1 m -73.76 142.81 80.75 Favored Pre-proline 0 N--CA 1.474 0.748 0 C-N-CA 123.494 0.718 . . . . 0.0 112.864 178.709 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 92.9 Cg_endo -75.45 162.92 35.26 Favored 'Trans proline' 0 CA--C 1.54 0.805 0 C-N-CA 122.986 2.458 . . . . 0.0 112.186 172.648 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 51.8 t -137.17 134.0 47.35 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 C-N-CA 125.461 1.504 . . . . 0.0 110.313 177.479 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -68.14 133.0 91.7 Favored Pre-proline 0 CA--C 1.547 0.849 0 CA-C-O 118.237 -0.887 . . . . 0.0 111.608 -175.23 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 3.2 Cg_exo -65.07 166.49 18.56 Favored 'Trans proline' 0 CA--C 1.541 0.839 0 C-N-CA 122.69 2.26 . . . . 0.0 113.221 -178.611 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 36.9 Cg_exo -60.26 160.66 22.32 Favored 'Trans proline' 0 CA--C 1.54 0.778 0 C-N-CA 122.998 2.465 . . . . 0.0 112.364 162.688 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B 1736 ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -131.81 173.83 10.76 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 124.694 1.198 . . . . 0.0 112.116 175.639 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B 1737 ' ' ARG . . . . . . . . . . . . . 51.5 mtt180 -135.4 97.72 3.77 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 126.918 2.087 . . . . 0.0 107.838 177.13 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B 1738 ' ' ARG . . . . . . . . . . . . . 46.5 mtt85 -68.47 160.2 30.21 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-O 121.455 0.645 . . . . 0.0 111.362 -179.841 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B 1739 ' ' ARG . . . . . . . . . . . . . 46.6 ptt85 -84.24 50.05 1.78 Allowed 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 124.845 1.258 . . . . 0.0 112.258 171.421 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B 1740 ' ' GLY . . . . . . . . . . . . . . . 67.06 178.69 10.57 Favored Glycine 0 CA--C 1.538 1.51 0 N-CA-C 111.527 -0.629 . . . . 0.0 111.527 -151.766 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B 1741 ' ' ARG . . . . . . . . . . . . . 77.5 mtm180 -75.39 54.91 0.76 Allowed 'General case' 0 N--CA 1.481 1.092 0 O-C-N 120.869 -1.371 . . . . 0.0 112.335 173.577 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B 1742 ' ' ASN . . . . . . . . . . . . . 70.7 m-80 -117.21 10.44 13.8 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 126.416 1.887 . . . . 0.0 113.358 -172.196 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B 1743 ' ' LEU . . . . . . . . . . . . . 8.0 mp -61.07 148.11 41.51 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 123.815 0.846 . . . . 0.0 109.382 176.57 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B 1744 ' ' THR . . . . . . . . . . . . 0.356 0.2 OUTLIER . . . . . 0 C--O 1.248 1.008 0 N-CA-C 118.032 2.605 . . . . 0.0 118.032 -167.345 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 513' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 1.0 0 N-CA-C 110.854 -0.898 . . . . 0.0 110.854 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 514' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.57 -25.22 0.47 Allowed 'General case' 0 N--CA 1.476 0.837 0 N-CA-C 117.31 2.337 . . . . 0.0 117.31 -169.871 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 9.0 tt 57.71 -45.43 0.05 OUTLIER 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 128.148 2.579 . . . . 0.0 115.865 -166.619 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 516' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -42.71 147.09 0.32 Allowed 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 129.918 3.287 . . . . 0.0 118.394 178.406 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 517' ' ' LEU . . . . . 0.447 HD22 HD22 ' A' ' 548' ' ' LEU . 12.8 mt -131.9 158.28 75.9 Favored Pre-proline 0 CA--C 1.544 0.732 0 C-N-CA 125.567 1.547 . . . . 0.0 113.32 -169.456 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_endo -67.71 160.82 46.49 Favored 'Trans proline' 0 CA--C 1.543 0.97 0 C-N-CA 124.304 3.336 . . . . 0.0 114.622 -172.875 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 66.2 Cg_endo -64.07 133.53 38.77 Favored 'Trans proline' 0 C--N 1.349 0.558 0 C-N-CA 123.267 2.645 . . . . 0.0 110.488 177.56 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 73.8 0.61 55.99 Favored Glycine 0 CA--C 1.535 1.292 0 CA-C-O 117.36 -1.8 . . . . 0.0 115.386 -175.785 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 38.7 t80 -36.59 123.31 0.81 Allowed 'General case' 0 C--N 1.349 0.582 0 CA-C-N 120.717 2.258 . . . . 0.0 116.634 179.823 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 50.1 mtm -94.98 -54.2 3.54 Favored 'General case' 0 N--CA 1.465 0.316 0 C-N-CA 123.252 0.621 . . . . 0.0 111.28 -177.206 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 523' ' ' PHE . . . . . . . . . . . . . 24.9 p90 -167.96 167.16 12.93 Favored 'General case' 0 C--O 1.223 -0.314 0 C-N-CA 126.646 1.978 . . . . 0.0 113.085 -172.685 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 524' ' ' LYS . . . . . 0.583 ' HB2' HG23 ' A' ' 592' ' ' VAL . 80.6 mttt -100.26 161.74 13.41 Favored 'General case' 0 C--N 1.326 -0.433 0 O-C-N 121.3 -0.875 . . . . 0.0 111.039 167.616 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 18.0 m -136.86 154.88 32.27 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 C-N-CA 126.742 2.017 . . . . 0.0 108.794 167.833 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 44.6 tt0 -118.68 129.13 55.12 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 119.698 1.135 . . . . 0.0 111.261 173.063 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 527' ' ' ALA . . . . . 0.504 ' HA ' HG22 ' A' ' 589' ' ' THR . . . -62.72 119.32 9.06 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 124.028 0.931 . . . . 0.0 112.181 -178.444 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 44.7 mm-40 -85.79 -15.31 42.44 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 125.734 1.614 . . . . 0.0 111.932 173.958 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 92.3 m-70 -147.75 156.87 43.2 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 126.067 1.747 . . . . 0.0 111.369 -172.512 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -81.91 124.22 29.54 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 125.416 1.486 . . . . 0.0 114.646 175.957 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 88.4 t80 -129.87 114.56 16.04 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 124.68 1.192 . . . . 0.0 112.333 -177.426 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -83.04 125.63 31.67 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 124.341 1.056 . . . . 0.0 113.425 171.856 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -64.39 137.58 57.97 Favored 'General case' 0 CA--C 1.537 0.474 0 O-C-N 121.293 -0.879 . . . . 0.0 110.48 175.708 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 534' ' ' THR . . . . . . . . . . . . 0.272 2.0 t -132.35 3.53 3.94 Favored 'General case' 0 N--CA 1.473 0.722 0 N-CA-C 115.501 1.667 . . . . 0.0 115.501 -173.211 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -136.09 159.43 41.75 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 126.834 2.054 . . . . 0.0 115.1 165.509 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 1.2 t -61.76 -12.18 15.76 Favored 'General case' 0 N--CA 1.476 0.833 0 N-CA-C 117.143 2.275 . . . . 0.0 117.143 -172.563 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 17.5 p30 -111.91 -0.79 15.69 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 127.716 2.406 . . . . 0.0 116.366 177.866 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 76.7 mt-10 -81.47 144.11 31.59 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 114.437 1.273 . . . . 0.0 114.437 -175.634 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -84.86 152.23 23.73 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 125.825 1.65 . . . . 0.0 109.945 171.133 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -119.3 128.21 53.93 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 125.101 1.36 . . . . 0.0 110.541 -176.734 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 74.4 mt -128.07 146.72 50.6 Favored 'General case' 0 N--CA 1.471 0.575 0 C-N-CA 124.761 1.224 . . . . 0.0 112.25 -168.935 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -120.35 143.46 48.38 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 126.86 2.064 . . . . 0.0 109.404 173.232 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -55.77 99.69 0.03 OUTLIER 'General case' 0 CA--C 1.552 1.021 0 CA-C-N 119.619 1.099 . . . . 0.0 112.533 178.889 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 125.99 -7.22 7.73 Favored Glycine 0 CA--C 1.537 1.461 0 C-N-CA 126.545 2.021 . . . . 0.0 115.174 -173.728 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 80.4 m-20 -73.04 121.75 20.65 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-N 120.18 1.99 . . . . 0.0 114.223 -177.609 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 4.1 t -73.36 133.99 30.6 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 CA-C-N 119.386 0.994 . . . . 0.0 111.373 165.306 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 1.4 t -119.74 124.63 73.19 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.516 0 C-N-CA 126.173 1.789 . . . . 0.0 111.048 172.492 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 548' ' ' LEU . . . . . 0.451 ' CD2' ' HE2' ' A' ' 524' ' ' LYS . 22.5 mt -80.28 98.63 7.49 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 174.637 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 549' ' ' VAL . . . . . . . . . . . . . 4.1 t -62.95 130.4 27.52 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 N-CA-C 114.449 1.277 . . . . 0.0 114.449 174.283 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 20.9 pt -127.3 157.65 71.9 Favored Pre-proline 0 CA--C 1.546 0.805 0 C-N-CA 127.034 2.134 . . . . 0.0 109.838 177.73 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo -71.05 154.27 62.64 Favored 'Trans proline' 0 CA--C 1.54 0.789 0 C-N-CA 123.358 2.705 . . . . 0.0 112.431 174.565 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 43.5 m-85 -67.1 155.79 37.82 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 116.855 2.168 . . . . 0.0 116.855 177.994 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 553' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -65.96 -21.01 66.39 Favored 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 114.653 1.353 . . . . 0.0 114.653 -178.666 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 4.0 t30 -160.94 151.2 14.73 Favored Pre-proline 0 CA--C 1.545 0.787 0 C-N-CA 126.114 1.766 . . . . 0.0 107.963 178.338 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 555' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -68.47 -30.93 28.56 Favored 'Trans proline' 0 CA--C 1.536 0.611 0 C-N-CA 123.839 3.026 . . . . 0.0 112.567 -175.741 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 17.6 pt-20 -90.55 -11.63 39.53 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 114.347 1.239 . . . . 0.0 114.347 -179.632 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 557' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.94 -26.94 43.58 Favored 'General case' 0 CA--C 1.543 0.679 0 O-C-N 121.631 -0.668 . . . . 0.0 111.831 171.719 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 40.6 tt0 -60.81 120.52 10.28 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 126.048 1.739 . . . . 0.0 113.995 -177.607 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -85.49 131.28 34.4 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.175 1.39 . . . . 0.0 109.158 -177.867 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 73.6 tt0 -60.66 130.74 48.01 Favored 'General case' 0 N--CA 1.472 0.654 0 O-C-N 121.014 -1.054 . . . . 0.0 111.68 178.023 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 84.89 -12.02 58.45 Favored Glycine 0 CA--C 1.532 1.148 0 C-N-CA 124.833 1.206 . . . . 0.0 114.966 -178.7 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 48.6 m95 -91.48 155.48 18.39 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 124.664 1.186 . . . . 0.0 113.048 178.98 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 14.1 mt -126.76 151.94 47.54 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 124.038 0.935 . . . . 0.0 110.455 170.345 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 56.5 ttm -109.84 143.4 39.78 Favored 'General case' 0 N--CA 1.464 0.243 0 C-N-CA 124.179 0.992 . . . . 0.0 111.003 174.842 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -170.9 -172.9 37.61 Favored Glycine 0 CA--C 1.524 0.597 0 C-N-CA 123.888 0.756 . . . . 0.0 112.765 177.898 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 14.1 p -133.63 139.61 48.44 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.487 0 C-N-CA 125.232 1.413 . . . . 0.0 108.79 170.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 36.4 mtmt -58.49 136.68 57.58 Favored 'General case' 0 N--CA 1.467 0.418 0 O-C-N 121.215 -0.928 . . . . 0.0 111.16 175.71 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 19.6 tt0 -61.73 -40.74 96.17 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 118.281 -0.866 . . . . 0.0 110.876 179.436 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 34.3 m -61.38 -35.62 77.99 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 119.456 1.025 . . . . 0.0 112.663 176.48 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 67.1 m-20 -68.34 -46.62 69.66 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 125.742 1.617 . . . . 0.0 115.067 174.351 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 53.4 t-105 -66.94 -33.63 76.0 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 124.315 1.046 . . . . 0.0 112.242 174.532 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 4.2 t-20 -73.35 -23.7 60.25 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.273 1.429 . . . . 0.0 112.672 172.097 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 38.3 mt-30 -77.17 0.25 22.46 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 125.046 1.338 . . . . 0.0 113.399 168.279 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 91.9 m-70 62.18 31.71 17.55 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.442 1.497 . . . . 0.0 113.483 172.94 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 79.1 mttt -76.72 157.58 31.61 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 126.046 1.738 . . . . 0.0 112.083 177.176 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -62.23 113.47 2.9 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 124.348 1.059 . . . . 0.0 113.145 174.426 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 59.6 tp -56.32 -42.74 78.14 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.465 1.506 . . . . 0.0 112.046 -178.814 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 23.9 pt-20 -68.95 -8.36 43.79 Favored 'General case' 0 N--CA 1.477 0.88 0 N-CA-C 115.06 1.504 . . . . 0.0 115.06 -173.778 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 34.8 mmtp -111.72 -41.35 4.07 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 124.72 1.208 . . . . 0.0 111.778 166.78 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 96.6 m -76.49 -17.47 59.27 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 115.059 1.503 . . . . 0.0 115.059 -172.18 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 20.4 ptt180 -65.13 163.85 14.22 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 125.011 1.324 . . . . 0.0 112.629 169.279 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -167.11 174.18 42.36 Favored Glycine 0 CA--C 1.526 0.754 0 CA-C-N 114.734 -1.121 . . . . 0.0 113.985 169.542 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 31.5 m -93.55 140.83 15.74 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.594 0 C-N-CA 124.748 1.219 . . . . 0.0 110.705 168.333 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 40.9 p90 -138.02 156.54 74.03 Favored Pre-proline 0 CA--C 1.543 0.684 0 C-N-CA 124.274 1.03 . . . . 0.0 113.245 177.291 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -66.97 111.89 2.33 Favored 'Trans proline' 0 CA--C 1.535 0.571 0 C-N-CA 122.629 2.219 . . . . 0.0 110.169 170.015 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 22.1 pt-20 -56.22 -29.83 61.51 Favored 'General case' 0 N--CA 1.475 0.821 0 O-C-N 121.309 -0.87 . . . . 0.0 112.5 -178.72 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 13.0 p-10 -69.2 -14.14 62.8 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 127.019 2.127 . . . . 0.0 113.867 -179.587 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 18.8 m-85 -75.21 -8.86 57.78 Favored 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 116.952 2.205 . . . . 0.0 116.952 164.64 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 589' ' ' THR . . . . . 0.504 HG22 ' HA ' ' A' ' 527' ' ' ALA . 70.0 p -130.3 168.48 16.82 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 125.39 1.476 . . . . 0.0 111.827 -173.387 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -124.52 137.86 54.38 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 123.93 0.892 . . . . 0.0 109.791 173.422 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.93 137.85 56.36 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 124.712 1.205 . . . . 0.0 110.549 174.871 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 592' ' ' VAL . . . . . 0.583 HG23 ' HB2' ' A' ' 524' ' ' LYS . 2.7 m -130.18 162.52 53.62 Favored Pre-proline 0 N--CA 1.48 1.029 0 C-N-CA 125.623 1.569 . . . . 0.0 109.601 178.322 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 593' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo . . . . . 0 C--O 1.255 1.338 0 C-N-CA 124.626 3.551 . . . . 0.0 115.067 -178.714 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B 1728 ' ' SER . . . . . . . . . . . . . 58.5 p . . . . . 0 N--CA 1.474 0.75 0 CA-C-O 118.626 -0.702 . . . . 0.0 112.213 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B 1729 ' ' THR . . . . . . . . . . . . 0.276 1.3 p -123.88 -17.4 6.32 Favored 'General case' 0 N--CA 1.481 1.125 0 N-CA-C 117.293 2.331 . . . . 0.0 117.293 -176.78 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B 1730 ' ' VAL . . . . . . . . . . . . . 2.5 m -94.67 148.19 34.45 Favored Pre-proline 0 N--CA 1.479 1.008 0 N-CA-C 114.138 1.162 . . . . 0.0 114.138 179.085 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -77.98 169.79 19.91 Favored 'Trans proline' 0 CA--C 1.541 0.847 0 C-N-CA 124.366 3.377 . . . . 0.0 113.535 174.57 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 90.6 t -131.93 136.8 56.18 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.854 0 C-N-CA 126.559 1.944 . . . . 0.0 108.431 173.629 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -62.34 139.04 96.41 Favored Pre-proline 0 CA--C 1.547 0.864 0 O-C-N 121.78 -0.575 . . . . 0.0 111.952 -177.344 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -69.04 161.36 46.15 Favored 'Trans proline' 0 CA--C 1.539 0.738 0 C-N-CA 121.976 1.784 . . . . 0.0 110.587 177.995 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 46.9 Cg_exo -55.78 153.68 29.53 Favored 'Trans proline' 0 N--CA 1.459 -0.51 0 C-N-CA 122.227 1.952 . . . . 0.0 111.95 176.194 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B 1736 ' ' ARG . . . . . . . . . . . . . 80.1 mtp180 -104.96 146.0 29.64 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 123.817 0.847 . . . . 0.0 110.505 164.456 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B 1737 ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -165.55 176.62 8.0 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 125.281 1.432 . . . . 0.0 113.065 -152.196 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B 1738 ' ' ARG . . . . . . . . . . . . . 62.2 ttt180 69.58 -38.79 0.41 Allowed 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 128.97 2.908 . . . . 0.0 117.475 170.546 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B 1739 ' ' ARG . . . . . . . . . . . . . 81.5 mtm180 -64.68 132.8 50.69 Favored 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 115.42 1.637 . . . . 0.0 115.42 -162.205 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B 1740 ' ' GLY . . . . . . . . . . . . . . . 83.85 -158.95 35.65 Favored Glycine 0 CA--C 1.532 1.105 0 N-CA-C 114.895 0.718 . . . . 0.0 114.895 165.401 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B 1741 ' ' ARG . . . . . . . . . . . . . 24.2 ttm105 56.28 55.7 6.44 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 125.97 1.708 . . . . 0.0 112.637 -175.471 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B 1742 ' ' ASN . . . . . . . . . . . . . 51.5 t30 -74.62 -32.5 62.34 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.475 1.11 . . . . 0.0 112.096 175.96 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B 1743 ' ' LEU . . . . . . . . . . . . . 4.2 mm? -104.88 160.83 14.7 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.975 1.31 . . . . 0.0 111.487 178.685 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B 1744 ' ' THR . . . . . . . . . . . . 0.289 5.8 p . . . . . 0 C--O 1.255 1.345 0 C-N-CA 125.172 1.389 . . . . 0.0 113.714 169.789 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 513' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.946 0 N-CA-C 111.103 -0.799 . . . . 0.0 111.103 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 514' ' ' ARG . . . . . . . . . . . . . 12.6 ptm180 -144.25 169.62 17.55 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 125.657 1.583 . . . . 0.0 110.074 177.913 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -120.34 -35.48 3.42 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 124.737 1.215 . . . . 0.0 111.311 -179.458 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 516' ' ' ASP . . . . . . . . . . . . . 48.2 t0 -67.23 140.91 57.42 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 125.401 1.48 . . . . 0.0 111.737 -179.928 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 517' ' ' LEU . . . . . 0.469 HD22 HD22 ' A' ' 548' ' ' LEU . 13.2 mt -116.9 162.12 28.99 Favored Pre-proline 0 CA--C 1.543 0.676 0 C-N-CA 127.305 2.242 . . . . 0.0 111.404 -172.369 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_endo -66.99 162.33 38.57 Favored 'Trans proline' 0 CA--C 1.538 0.718 0 C-N-CA 123.436 2.757 . . . . 0.0 114.776 -171.245 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -56.78 128.58 30.55 Favored 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 123.793 2.996 . . . . 0.0 111.077 176.536 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 520' ' ' GLY . . . . . . . . . . . . . . . 73.9 2.26 61.04 Favored Glycine 0 CA--C 1.535 1.311 0 CA-C-O 116.956 -2.024 . . . . 0.0 116.384 -176.851 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 35.7 t80 -38.48 127.54 1.44 Allowed 'General case' 0 C--N 1.349 0.563 0 CA-C-N 121.053 2.427 . . . . 0.0 116.909 -175.741 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 522' ' ' MET . . . . . . . . . . . . . 48.8 mtm -104.25 -53.17 2.78 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 123.631 0.772 . . . . 0.0 112.116 -176.911 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 523' ' ' PHE . . . . . . . . . . . . . 25.6 p90 -166.58 172.29 10.86 Favored 'General case' 0 N--CA 1.465 0.322 0 C-N-CA 125.775 1.63 . . . . 0.0 113.181 -174.539 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 524' ' ' LYS . . . . . 0.542 ' HE2' ' CD2' ' A' ' 548' ' ' LEU . 78.3 mttt -104.52 164.8 11.49 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 121.214 -0.929 . . . . 0.0 112.446 170.369 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 525' ' ' VAL . . . . . . . . . . . . . 14.6 m -133.85 161.92 40.22 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 126.686 1.995 . . . . 0.0 109.383 164.688 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 526' ' ' GLN . . . . . . . . . . . . . 33.1 tt0 -125.44 130.01 50.98 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-N 118.929 0.786 . . . . 0.0 111.919 168.703 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 527' ' ' ALA . . . . . 0.475 ' HA ' HG22 ' A' ' 589' ' ' THR . . . -62.28 127.25 30.48 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.098 0.959 . . . . 0.0 111.518 178.613 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 40.1 mm-40 -88.66 -29.05 20.21 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 125.409 1.483 . . . . 0.0 110.813 170.634 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 97.5 m-70 -137.34 157.19 47.15 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 126.13 1.772 . . . . 0.0 111.518 -176.198 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 14.8 p-10 -83.12 131.6 35.13 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 114.908 1.447 . . . . 0.0 114.908 178.085 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 531' ' ' TYR . . . . . . . . . . . . . 78.0 t80 -133.75 116.5 15.82 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.337 1.055 . . . . 0.0 112.356 -172.335 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 2.3 m -83.77 125.61 32.09 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 114.947 1.462 . . . . 0.0 114.947 176.657 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -71.67 142.49 49.88 Favored 'General case' 0 CA--C 1.538 0.508 0 O-C-N 121.459 -0.775 . . . . 0.0 111.702 172.634 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 2.9 t -138.44 -4.59 1.64 Allowed 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 126.476 1.91 . . . . 0.0 115.78 -175.845 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 535' ' ' ASP . . . . . . . . . . . . . 19.6 m-20 -119.53 155.04 32.92 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 127.138 2.175 . . . . 0.0 116.018 164.082 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 5.6 t -55.75 -22.63 25.05 Favored 'General case' 0 N--CA 1.477 0.911 0 N-CA-C 116.62 2.081 . . . . 0.0 116.62 -179.628 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 70.1 m-20 -99.05 -8.14 25.75 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 115.622 1.712 . . . . 0.0 115.622 177.337 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 11.8 mt-10 -74.52 157.07 36.14 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 114.89 1.441 . . . . 0.0 114.89 -177.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -103.7 137.37 41.83 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 127.807 2.443 . . . . 0.0 111.147 173.808 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 540' ' ' GLN . . . . . . . . . . . . . 33.4 tt0 -94.12 121.73 35.92 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.955 1.302 . . . . 0.0 111.512 176.443 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 71.2 mt -118.52 148.18 42.89 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.645 1.178 . . . . 0.0 113.076 -177.429 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 542' ' ' LYS . . . . . . . . . . . . . 5.9 tppt? -112.25 145.04 40.65 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 127.245 2.218 . . . . 0.0 110.296 166.294 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 543' ' ' ALA . . . . . . . . . . . . . . . -56.46 104.04 0.13 Allowed 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.694 0.798 . . . . 0.0 110.565 172.237 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 544' ' ' GLY . . . . . . . . . . . . . . . 121.18 -9.45 10.24 Favored Glycine 0 CA--C 1.535 1.305 0 C-N-CA 125.925 1.726 . . . . 0.0 114.736 -173.183 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 545' ' ' ASP . . . . . . . . . . . . . 88.7 m-20 -70.56 124.9 25.35 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 119.854 1.827 . . . . 0.0 114.945 -178.973 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 546' ' ' VAL . . . . . . . . . . . . . 2.4 t -74.65 136.54 24.95 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 CA-C-N 118.313 0.506 . . . . 0.0 111.615 165.333 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 547' ' ' VAL . . . . . . . . . . . . . 1.2 t -128.55 121.4 55.03 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 C-N-CA 124.69 1.196 . . . . 0.0 111.703 176.523 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 548' ' ' LEU . . . . . 0.542 ' CD2' ' HE2' ' A' ' 524' ' ' LYS . 17.2 mt -77.83 100.54 6.36 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.697 1.199 . . . . 0.0 108.533 175.792 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 549' ' ' VAL . . . . . . . . . . . . . 7.2 t -61.42 130.24 25.3 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.966 0 N-CA-C 113.945 1.091 . . . . 0.0 113.945 173.118 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 550' ' ' ILE . . . . . . . . . . . . . 8.3 pt -127.61 156.76 74.91 Favored Pre-proline 0 CA--C 1.542 0.659 0 C-N-CA 126.443 1.897 . . . . 0.0 109.564 178.102 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 80.0 Cg_endo -70.78 154.19 63.85 Favored 'Trans proline' 0 CA--C 1.538 0.715 0 C-N-CA 123.016 2.477 . . . . 0.0 111.523 171.083 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 33.1 m-85 -65.32 156.96 30.42 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 115.581 1.697 . . . . 0.0 115.581 172.02 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 553' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -65.38 -25.93 67.79 Favored 'General case' 0 CA--C 1.546 0.798 0 N-CA-C 113.115 0.783 . . . . 0.0 113.115 169.956 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 20.6 m-80 -146.92 148.27 32.18 Favored Pre-proline 0 CA--C 1.544 0.738 0 C-N-CA 125.963 1.705 . . . . 0.0 112.516 175.347 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 555' ' ' PRO . . . . . . . . . . . . . 92.9 Cg_endo -70.77 -30.12 18.05 Favored 'Trans proline' 0 CA--C 1.539 0.747 0 C-N-CA 123.91 3.073 . . . . 0.0 113.199 178.787 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 -76.85 -25.33 53.02 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 113.578 0.955 . . . . 0.0 113.578 174.711 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 557' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -74.26 -23.12 59.09 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 123.971 0.908 . . . . 0.0 112.954 177.229 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 38.4 tt0 -64.03 136.83 57.64 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 125.7 1.6 . . . . 0.0 113.184 174.166 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 559' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -114.85 137.36 52.05 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 126.657 1.983 . . . . 0.0 113.757 -176.848 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 39.8 tp10 -74.39 133.95 42.45 Favored 'General case' 0 N--CA 1.474 0.744 0 O-C-N 120.406 -1.434 . . . . 0.0 112.664 -168.847 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 561' ' ' GLY . . . . . . . . . . . . . . . 84.36 -8.1 69.43 Favored Glycine 0 CA--C 1.536 1.359 0 C-N-CA 125.412 1.482 . . . . 0.0 114.264 -173.4 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 562' ' ' TRP . . . . . . . . . . . . . 60.2 m95 -92.58 161.41 14.6 Favored 'General case' 0 C--O 1.235 0.291 0 C-N-CA 125.389 1.476 . . . . 0.0 112.642 175.547 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 13.9 mt -132.99 152.15 51.99 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 124.815 1.246 . . . . 0.0 109.603 166.267 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 564' ' ' MET . . . . . . . . . . . . . 39.4 tpp -106.68 140.23 39.87 Favored 'General case' 0 N--CA 1.465 0.275 0 C-N-CA 124.46 1.104 . . . . 0.0 110.389 171.732 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 565' ' ' GLY . . . . . . . . . . . . . . . -165.33 -172.72 33.1 Favored Glycine 0 CA--C 1.523 0.564 0 CA-C-O 122.191 0.884 . . . . 0.0 113.395 174.376 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 566' ' ' VAL . . . . . . . . . . . . . 12.7 p -130.15 137.92 55.22 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.383 0 C-N-CA 125.386 1.474 . . . . 0.0 108.816 169.433 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 567' ' ' LYS . . . . . . . . . . . . . 29.4 mtmt -56.82 134.19 54.99 Favored 'General case' 0 N--CA 1.465 0.303 0 O-C-N 121.406 -0.809 . . . . 0.0 110.917 175.49 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -61.41 -38.75 88.22 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-O 118.993 -0.527 . . . . 0.0 111.042 177.686 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 569' ' ' SER . . . . . . . . . . . . . 10.8 t -66.07 -35.0 79.36 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 119.439 1.018 . . . . 0.0 112.246 175.5 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 570' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 -59.15 -51.11 71.44 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 114.024 1.12 . . . . 0.0 114.024 168.53 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 571' ' ' TRP . . . . . . . . . . . . . 61.9 t-105 -69.66 -32.54 71.24 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.685 1.594 . . . . 0.0 113.286 -178.817 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 572' ' ' ASN . . . . . . . . . . . . . 12.3 t-20 -78.95 -18.38 53.86 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 125.315 1.446 . . . . 0.0 112.607 173.949 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 573' ' ' GLN . . . . . . . . . . . . . 8.8 mm100 -90.08 5.26 47.49 Favored 'General case' 0 CA--C 1.546 0.822 0 CA-C-N 119.333 0.969 . . . . 0.0 113.514 163.509 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 83.8 m-70 61.85 25.81 15.56 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 126.367 1.867 . . . . 0.0 114.623 172.145 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 575' ' ' LYS . . . . . . . . . . . . . 78.4 mttt -68.24 155.29 40.0 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 125.448 1.499 . . . . 0.0 111.489 177.28 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 576' ' ' GLU . . . . . . . . . . . . . 6.9 pm0 -64.53 104.78 0.84 Allowed 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 114.295 1.22 . . . . 0.0 114.295 -169.133 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 56.1 tp -51.91 -45.06 64.09 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.348 1.059 . . . . 0.0 113.266 -173.961 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 578' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -66.28 -19.73 65.9 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 114.334 1.235 . . . . 0.0 114.334 -174.171 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 14.6 mmmm -100.37 -41.02 7.2 Favored 'General case' 0 N--CA 1.481 1.111 0 CA-C-N 119.104 0.865 . . . . 0.0 112.208 164.465 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 580' ' ' CYS . . . . . . . . . . . . . 91.0 m -71.59 -23.61 61.76 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 114.979 1.474 . . . . 0.0 114.979 -169.733 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 38.0 ptt180 -62.38 166.03 5.47 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 125.097 1.359 . . . . 0.0 112.293 172.03 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -176.92 169.45 41.84 Favored Glycine 0 CA--C 1.522 0.509 0 N-CA-C 114.888 0.715 . . . . 0.0 114.888 172.583 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 583' ' ' VAL . . . . . . . . . . . . . 31.6 m -86.06 145.71 7.42 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.213 0 C-N-CA 123.817 0.847 . . . . 0.0 110.872 170.909 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 584' ' ' PHE . . . . . . . . . . . . . 47.8 p90 -142.96 155.07 62.62 Favored Pre-proline 0 CA--C 1.545 0.752 0 C-N-CA 125.426 1.49 . . . . 0.0 112.186 174.831 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -68.19 113.61 3.13 Favored 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.361 2.04 . . . . 0.0 109.703 171.441 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 586' ' ' GLU . . . . . . . . . . . . . 20.2 pt-20 -58.6 -26.47 63.7 Favored 'General case' 0 N--CA 1.475 0.805 0 O-C-N 121.269 -0.894 . . . . 0.0 112.497 -177.668 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 587' ' ' ASN . . . . . . . . . . . . . 9.0 p-10 -68.77 -16.2 63.73 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 126.503 1.921 . . . . 0.0 114.435 176.73 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 588' ' ' PHE . . . . . . . . . . . . . 19.0 m-85 -72.78 -14.1 61.46 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 116.749 2.129 . . . . 0.0 116.749 162.008 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 589' ' ' THR . . . . . 0.475 HG22 ' HA ' ' A' ' 527' ' ' ALA . 64.1 p -124.27 177.27 5.94 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 126.173 1.789 . . . . 0.0 110.957 -176.261 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 590' ' ' GLU . . . . . . . . . . . . . 16.8 pt-20 -131.62 138.57 48.85 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.511 0.724 . . . . 0.0 110.368 170.35 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 591' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -70.85 111.75 6.51 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 125.465 1.506 . . . . 0.0 109.849 -177.511 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 592' ' ' VAL . . . . . 0.471 HG23 ' HB2' ' A' ' 524' ' ' LYS . 2.6 m -94.19 159.66 33.66 Favored Pre-proline 0 N--CA 1.479 1.014 0 C-N-CA 124.78 1.232 . . . . 0.0 109.428 -178.688 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 593' ' ' PRO . . . . . . . . . . . . . 92.4 Cg_endo . . . . . 0 C--O 1.249 1.068 0 C-N-CA 124.24 3.293 . . . . 0.0 114.326 -176.71 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B 1728 ' ' SER . . . . . . . . . . . . . 21.9 t . . . . . 0 N--CA 1.474 0.768 0 CA-C-O 120.743 0.306 . . . . 0.0 110.87 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B 1729 ' ' THR . . . . . . . . . . . . 0.254 0.9 OUTLIER -130.26 -8.96 4.25 Favored 'General case' 0 N--CA 1.482 1.152 0 N-CA-C 117.023 2.231 . . . . 0.0 117.023 176.894 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B 1730 ' ' VAL . . . . . . . . . . . . . 4.3 m -58.69 155.17 31.62 Favored Pre-proline 0 N--CA 1.479 0.975 0 C-N-CA 125.448 1.499 . . . . 0.0 113.23 -179.933 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B 1731 ' ' PRO . . . . . . . . . . . . . 39.0 Cg_endo -60.6 160.33 24.76 Favored 'Trans proline' 0 C--N 1.35 0.613 0 C-N-CA 123.057 2.505 . . . . 0.0 113.651 -177.467 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B 1732 ' ' VAL . . . . . . . . . . . . . 19.9 t -132.64 125.36 52.85 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 125.337 1.455 . . . . 0.0 111.445 -178.324 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B 1733 ' ' ALA . . . . . . . . . . . . . . . -66.04 141.11 97.33 Favored Pre-proline 0 CA--C 1.547 0.853 0 C-N-CA 123.639 0.776 . . . . 0.0 113.035 -174.443 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B 1734 ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -72.7 167.17 27.88 Favored 'Trans proline' 0 CA--C 1.547 1.149 0 C-N-CA 122.415 2.076 . . . . 0.0 112.579 175.557 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B 1735 ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -60.04 153.98 54.28 Favored 'Trans proline' 0 CA--C 1.536 0.608 0 C-N-CA 123.097 2.531 . . . . 0.0 113.244 174.495 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B 1736 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.45 154.2 42.36 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 124.743 1.217 . . . . 0.0 110.714 174.2 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B 1737 ' ' ARG . . . . . . . . . . . . . 32.1 mmt180 -130.84 129.73 42.72 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 125.665 1.586 . . . . 0.0 110.188 -169.694 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B 1738 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.12 130.61 40.65 Favored 'General case' 0 N--CA 1.478 0.956 0 CA-C-N 119.031 0.832 . . . . 0.0 112.604 176.734 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B 1739 ' ' ARG . . . . . . . . . . . . . 11.3 mmt-85 -158.38 151.0 22.16 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 127.396 2.279 . . . . 0.0 111.214 172.383 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B 1740 ' ' GLY . . . . . . . . . . . . . . . 82.66 152.65 11.37 Favored Glycine 0 CA--C 1.537 1.425 0 O-C-N 124.09 0.869 . . . . 0.0 113.211 175.198 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B 1741 ' ' ARG . . . . . . . . . . . . . 10.2 tpt180 -55.22 139.94 40.56 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 125.276 1.43 . . . . 0.0 113.177 -164.249 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B 1742 ' ' ASN . . . . . . . . . . . . . 20.4 p30 -140.25 -13.39 1.04 Allowed 'General case' 0 CA--C 1.55 0.947 0 N-CA-C 116.685 2.106 . . . . 0.0 116.685 179.682 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B 1743 ' ' LEU . . . . . . . . . . . . . 63.3 tp -54.24 121.49 8.31 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 125.273 1.429 . . . . 0.0 113.246 -175.692 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B 1744 ' ' THR . . . . . . . . . . . . 0.313 1.2 t . . . . . 0 C--O 1.254 1.319 0 N-CA-C 116.877 2.177 . . . . 0.0 116.877 -172.087 . . . . . . . . 1 1 . 1 stop_ save_